TerraTox - HIV-1 structure file, May 2004. Copyright ... - TerraBase Inc.

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3052 C20H22N2OS 2-(alkylthio)-pyrimidin-4-ol deriv.; T-4130-110 CCC(C)Sc1nc(O)c(C)c(n1)Cc2cccc3ccccc23 3053 C20H22N2OS 2-(alkylthio)-pyrimidin-4-ol deriv.; T-4130-104 CCC(CC)Sc1nc(O)cc(n1)Cc2cccc3ccccc23 3054 C20H22N2OS 2-(alkylthio)-pyrimidin-4-ol deriv.; T-4130-103 CCCC(C)Sc1nc(O)cc(n1)Cc2cccc3ccccc23 3055 C20H22N4O2 bis(heteroaryl)piperazine deriv.; T-4422-036 CCNc1cccnc1N2CCN(CC2)C(=O)c3cc4ccccc4o3 3056 C20H22N4OS bis(heteroaryl)piperazine deriv.; T-4422-038 CCNc1cccnc1N2CCN(CC2)C(=O)c3cc4ccccc4s3 3057 C20H22O5 (-)-arctigenin, 3'-demethoxy c1cc(OC)c(OC)cc1C[C@H]2COC(=O)[C@]2([H])Cc3ccc(O)cc3 3058 C20H22O6 (-)-arctigenin, 3''-demethoxy, 3'-hydroxy c1cc(OC)c(OC)cc1C[C@H]2COC(=O)[C@]2([H])Cc3cc(O)c(O)cc3 Stampidine; stavudine-5'-(p-bromophenyl methoxyalaninyl phosphate) 3059 C20H23BrN3O8P c1cc(Br)ccc1OP(=O)(N[C@@H](C)C(=O)OC)OC[C@@H]1C=C[C@@H](O1)N2C(=O)NC(= O)C(C)=C2 3060 C20H23NO4S O-(2-phenoxyethyl) thiocarbamate deriv.; T-4418-241 c1ccccc1OCC(C)OC(=S)N(c2ccccc2)C(=O)OCCC 3061 C20H23N5O 1-[(1H-indol-2-yl)carbonyl]-4-[(ethylamino)pyridin-2- yl]piperazine; T-4384-001 c1cccc2cc(nc12)C(=O)N3CCN(CC3)c4c(NCC)cccn4 3062 C20H23N5O 1-[(1H-indol-5-yl)carbonyl]-4-[(ethylamino)pyridin-2- yl]piperazine; T-4384-001 CCNc1cccnc1N2CCN(CC2)C(=O)c3ccc4nccc4c3 3063 C20H23N5O 1-[(1H-indol-7-yl)carbonyl]-4-[(ethylamino)pyridin-2- yl]piperazine; T-4384-001 CCNc1cccnc1N2CCN(CC2)C(=O)c3cccc4c3ncc4 3064 C20H23N5O2 1-[(5-hydroxy-1H-indol-2-yl)carbonyl]-4- [(ethylamino)pyridin-2-yl]piperazine; T-4384-003 c1cc(O)cc2cc(nc12)C(=O)N3CCN(CC3)c4c(NCC)cccn4 3065 C20H23N6O5P QYL-609 n1cnc(N)c2ncn(c12)/C=C3/CC3COP(=O)(Oc4ccccc4)NC(C)C(=O)OC 3066 C20H24BrN6O8P 3'-azido-3'-deoxythymidine-5'-(4-bromophenyl methoxyalaninyl phosphate) C1[C@H](N=N#N)[C@@H](COP(=O)(NC(C)C(=O)OC)Oc3ccc(Br)cc3)O[C@H]1N2C(=O)N C(=O)C(C)=C2 3067 C20H24ClNO2S2 1-(carbonyl/thiocarbonyl)anilide deriv.; T-4141-284 Cc1sccc1C(=S)Nc2ccc(Cl)c(c2)C(=O)OC(C(C)C)C(C)C 3068 C20H24ClNO2S2 NSC 648360; UC71 s1ccc(C)c1C(=S)Nc1cc(C(=O)OC(C(C)C)C(C)C)c(Cl)cc1 3069 C20H24ClNO2S2 1-(carbonyl/thiocarbonyl)anilide deriv.; T-4141-256 s1ccc(C)c1C(=S)Nc2ccc(Cl)c(c2)C(=O)OC(C(C)C)C(C)C 3070 C20H24ClNO3S 1-(carbonyl/thiocarbonyl)anilide deriv.; T-4141-226 c1coc(C)c1C(=S)Nc2ccc(Cl)c(c2)C(=O)OC(C(C)C)C(C)C 3071 C20H24ClNO3S NSC 645548; UC538 Cc1occc1C(=S)Nc1cc(C(=O)OC(C(C)C)C(C)C)c(Cl)cc1 3072 C20H24ClNO3S 1-(carbonyl/thiocarbonyl)anilide deriv.; T-4141-283 Cc1sccc1C(=O)Nc2ccc(Cl)c(c2)C(=O)OC(C(C)C)C(C)C 3073 C20H24FN10O10P A8 F[C@H]1[C@H](n8cnc9c(N)ncnc89)O[C@H](CO)[C@H]1OP(=O)(O)OC[C@H]2O[C@@H]( n8cnc9c(O)nc(N)nc89)[C@H](O)[C@@H]2O F[C@H]1[C@H](n8cnc9c(N)ncnc89)O[C@H](CO)[C@H]1OP(=O)(S)OC[C@H]2O[C@@H]( 3074 C20H24FN10O9PS A9 n8cnc9c(O)nc(N)nc89)[C@H](O)[C@@H]2O
3075 C20H24N4O2 6,11-dihydro-5H-pyrido[2,3-b][1,5]benzodiazepin-5-one deriv. n1cccc2C(=O)N(C)c3cc(C(=O)N(CC)CC)ccc3N(CC)c12 133626-79-6 3076 C20H24N7O5P QYL-685 n1c(N)nc(N)c2ncn(c12)/C=C3/CC3COP(=O)(Oc4ccccc4)NC(C)C(=O)OC 3077 C20H25ClN2O2S NSC 648344; UC79 Cn1cccc1C(=S)Nc1cc(C(=O)OC(C(C)C)C(C)C)c(Cl)cc1 3078 C20H25ClN2O2S 1-(carbonyl/thiocarbonyl)anilide deriv.; T-4141-249 Cn1cccc1C(=S)Nc2ccc(Cl)c(c2)C(=O)OC(C(C)C)C(C)C 3079 C20H25N10O10P A6 C1[C@H](n8cnc9c(N)ncnc89)O[C@H](CO)[C@H]1OP(=O)(O)OC[C@H]2O[C@@H](n8cnc 9c(O)nc(N)nc89)[C@H](O)[C@@H]2O 3080 C20H25N10O10P A4 C1[C@H](n8cnc9c(O)nc(N)nc89)O[C@H](CO)[C@H]1OP(=O)(O)OC[C@H]2O[C@@H](n8c nc9c(O)nc(N)nc89)[C@H]([H])[C@@H]2O 3081 C20H25N10O10P A10 O[C@H]1[C@H](n8cnc9c(N)ncnc89)O[C@H](CO)[C@H]1OP(=O)(O)OC[C@H]2O[C@@H]( n8cnc9c(N)ncnc89)[C@H](O)[C@@H]2O 3082 C20H25N10O10PS A3 C1[C@H](n8cnc9c(O)nc(N)nc89)O[C@H](CO)[C@H]1OP(=O)(S)OC[C@H]2O[C@@H](n8c nc9c(O)nc(N)nc89)[C@H](O)[C@@H]2O 3083 C20H25N10O11P A5 O[C@H]1[C@H](n8cnc9c(N)ncnc89)O[C@H](CO)[C@H]1OP(=O)(O)OC[C@H]2O[C@@H]( n8cnc9c(O)nc(N)nc89)[C@H](O)[C@@H]2O 3084 C20H25N10O11PS A2 O[C@H]1[C@H](n8cnc9c(O)nc(N)nc89)O[C@H](CO)[C@H]1OP(=O)(S)OC[C@H]2O[C@@ H](n8cnc9c(O)nc(N)nc89)[C@H](O)[C@@H]2O 3085 C20H25N10O12P A1 O[C@H]1[C@H](n8cnc9c(O)nc(N)nc89)O[C@H](CO)[C@H]1OP(=O)(O)OC[C@H]2O[C@ @H](n8cnc9c(O)nc(N)nc89)[C@H](O)[C@@H]2O 3086 C20H25N10O9PS A7 C1[C@H](n8cnc9c(N)ncnc89)O[C@H](CO)[C@H]1OP(=O)(S)OC[C@H]2O[C@@H](n8cnc9 c(O)nc(N)nc89)[C@H](O)[C@@H]2O 3087 C20H25N6O8P 3'-azido-3'-deoxythymidine-5'-(4-bromophenyl methoxyalaninyl phosphate) C1[C@H](N=N#N)[C@@H](COP(=O)(NC(C)C(=O)OC)Oc3ccccc3)O[C@H]1N2C(=O)NC(= O)C(C)=C2 3088 C20H25N9O3 Distamycin Nc1cn(C)c(c1)C(=O)Nc2cn(C)c(c2)C(=O)Nc3cnc(c3)C(=O)NCCC(N)=N 39389-47-4 3089 C20H26N2O2S2 HEPT analogue; T-3992-052 C1CCCCC1COCN1C(=S)NC(=O)C(CC)=C1Sc2ccccc2 144410-26-4 3090 C20H26N2O3 6-benzyl-5-isopropyl-1-(3-methylbut-2- enyloxymethyl)uracil C/C(C)=C/COCN1C(=O)NC(=O)C(C(C)C)=C1Cc2ccccc2 3091 C20H26N2O3 6-(3,5-dimethylbenzyl)-5-ethyl-1-(2- methylallyloxymethyl)uracil C=C(C)COCN1C(=O)NC(=O)C(CC)=C1Cc2cc(C)cc(C)c2 3092 C20H26N2O3 1-(allyloxymethyl)-6-(3,5-dimethylbenzyl)-5- isopropyluracil C=CCOCN1C(=O)NC(=O)C(C(C)C)=C1Cc2cc(C)cc(C)c2 3093 C20H26N2O3S HEPT analogue; T-3992-066 C1CCCCC1COCN1C(=O)NC(=O)C(CC)=C1Sc2ccccc2 136160-42-4 3094 C20H26N2O4S cyclic sulfondiamide deriv.; T-4409-004 O[C@H]1[C@@H](Cc2ccccc2)N(C)S(=O)(=O)N(C)[C@H](Cc3ccccc3)[C@@H]1O 3095 C20H26N2OS 2-(alkylthio)-pyrimidin-4-ol deriv.; T-4130-506 C1CCCCC1SC2N(C)C(=O)C(C)=C(N=2)Cc3cc(C)ccc3 3096 C20H26N2OS 2-(alkylthio)-pyrimidin-4-ol deriv.; T-4130-505 C1CCCCC1Sc2nc(OC)c(C)c(n2)Cc3cc(C)ccc3 2',3'-dideoxy-3'-(mercapto)thymidine (3'-S)-disulfide dimer 3097 C20H26N4O8S2 C1[C@H](S3)[C@@H](CO)O[C@H]1N2C(=O)NC(=O)C(C)=C2.C1[C@H](S3)[C@@H](CO) O[C@H]1N2C(=O)NC(=O)C(C)=C2 107601-08-1 3098 C20H27N5S2 2-(alkylthio)-pyrimidin-4-ol deriv.; T-4130-508 C1CCCCC1Sc2nc(NNC(=S)N)c(C)c(n2)Cc3cc(C)ccc3 3099 C20H28N2O3 HEPT analogue; T-4007-036 CCOC(CC)N1C(=O)NC(=O)C(CC)=C1Cc2cc(C)cc(C)c2
Page 1 and 2:
TerraTox - HIV-1 structure file, Ma
Page 3 and 4:
46 C8H9BrN2O5 47 C8H9BrN2O5 alpha-(
Page 5 and 6:
109 C8H11N3O3S (-)-2'-deoxy-3'-oxa-
Page 7 and 8:
156 C9H9F2N3O3 157 C9H9F2N3O3 158 C
Page 9 and 10:
213 C9H10O4 214 C9H10O5 ethyl 3,4-d
Page 11 and 12:
274 C9H13FN5O4P (2R/S)-6-amino-9-[2
Page 13 and 14:
325 C10H9F2N5O2 9-(2',3'-dideoxy-2'
Page 15 and 16:
376 C10H12FN5O2 2',3'-dideoxyadenos
Page 17 and 18:
433 C10H14FN3O3 1-(2-fluoro-2,3-did
Page 19 and 20:
484 C11H8ClNO2S2 thiazolothiazepine
Page 21 and 22:
545 C11H14N2O4 HEPT analogue; T-398
Page 23 and 24:
597 C12H8ClN5O2 5CITEP; 3-hydroxypr
Page 25 and 26:
645 C12H11ClFN3OS phenethylthiazoly
Page 27 and 28:
698 C12H14N2O3 pyridin-2-ol deriv.;
Page 29 and 30:
749 C13H9BrN2OS 2-amino-6-arylsulfo
Page 31 and 32:
794 C13H11ClN2O3S2 795 C13H11ClN2O3
Page 33 and 34:
843 C13H13ClN2O4S N-(3-chloro-6-ami
Page 35 and 36:
898 C13H15N3OS2 N-(thiazol-2-yl)hio
Page 37 and 38:
951 C14H7F6NO2 Efavirenz analogue;
Page 39 and 40:
1003 C14H9N3S 2-amino-6-arylsulfony
Page 41 and 42:
1052 C14H11F4NO2 Efavirenz analogue
Page 43 and 44:
1096 C14H12N2O3S 2-amino-6-arylsulf
Page 45 and 46:
1142 C14H13N3O 5,11-dihydro-6H-pyri
Page 47 and 48:
1190 C14H15ClN2O2S 1191 C14H15ClN2O
Page 49 and 50:
1243 C14H16N2O3S HEPT derivative; T
Page 51 and 52:
1297 C14H17N3OS 2-(sec-butoxy)-4-am
Page 53 and 54:
1350 C15H8Cl2O3 3-hydroxyflavone, 3
Page 55 and 56:
1406 C15H11F3N2O2S 2-amino-6-arylsu
Page 57 and 58:
1459 C15H12O4 1,3-di(4-hydroxy-3-me
Page 59 and 60:
1510 C15H14FN3O 1511 C15H14FN3O 151
Page 61 and 62:
1558 C15H15N3O 5,11-dihydro-6H-pyri
Page 63 and 64: 1614 C15H16N4O dipyridodiazepinone
Page 65 and 66: 1673 C15H18N2O2S 2-(4-methylphenylt
Page 67 and 68: 1733 C15H19N3O2 pyrid-2-ol deriv.;
Page 69 and 70: 1786 C16H6O8S 3,4-dicarboxylic acid
Page 71 and 72: 1827 C16H13ClF3N3O 6,11-dihydro-5H-
Page 73 and 74: 1884 C16H15F3N2O3 Efavirenz analogu
Page 75 and 76: 1939 C16H16N2O4S NSC 667948 c1c([H]
Page 77 and 78: 1991 C16H18Cl2N2OS pyrimidin-4-ol d
Page 79 and 80: 2054 C16H19N3O3S pyrimidin-4-ol der
Page 81 and 82: 2117 C16H20N2O4 2118 C16H20N2O4S OC
Page 83 and 84: 2180 C16H24N6O5 2181 C16H26N2O5Si 2
Page 85 and 86: 2231 C17H15ClN2O4S indolyl aryl sul
Page 87 and 88: 2294 C17H17N2O7P 7-methyl-cyclo-sal
Page 89 and 90: 2350 C17H19ClF2N4S phenethylthiazol
Page 91 and 92: 2405 C17H20N2O3 N-benzyl-6,7-dihydr
Page 93 and 94: 2472 C17H23N3O TIBO deriv.; T-4175-
Page 95 and 96: 2529 C18H14N2O3S2 1H-thieno[2,3-c][
Page 97 and 98: 2587 C18H18N2O2 pyridin-2-ol deriv.
Page 99 and 100: threo-2,3-di(3,4-dihydroxybenzyl)su
Page 101 and 102: 2702 C18H24ClN3S R86162 c1c(Cl)cc2N
Page 103 and 104: 2756 C18H31N3O8SSi 2757 C18H31N3O8S
Page 105 and 106: 2803 C19H18BrN5OS N-[2-(6,7-dihydro
Page 107 and 108: 2855 C19H20N5O5P 3-methyl-cyclo-sal
Page 109 and 110: 2908 C19H24O9 chromene glucuside Cc
Page 111 and 112: 2966 C20H17N2O7P benzo[c]-cyclo-sal
Page 113: 3026 C20H21N3O TIBO deriv.; T-4169-
Page 117 and 118: 3126 C21H14F4N2 1,2-diphenylbenzimi
Page 119 and 120: 3190 C21H20Br2O6 alkenyldiarylmetha
Page 121 and 122: 3248 C21H23N3O2 bis(heteroaryl)pipe
Page 123 and 124: 3291 C21H29ClN4O2 bis(heteroaryl)pi
Page 125 and 126: 3343 C22H20ClN5O2 diazepinone deriv
Page 127 and 128: 3402 C22H26O5 (+)-cathonolide A O[C
Page 129 and 130: 3446 C22H31NO5 3449 C22H33NO4 estra
Page 131 and 132: 3499 C23H22N2O6S2 1H-thieno[2,3-c][
Page 133 and 134: 3538 C23H28O5 10,11-cis-10,11-dihyd
Page 135 and 136: 3585 C24H24O12 1,4,8-trihydroxynaph
Page 137 and 138: 3630 C24H42IN3O8SSi2 TSAO deriv.; T
Page 139 and 140: 3674 C25H24O12 (-)-3,5-dicaffeoyl-m
Page 141 and 142: 3721 C25H34N10NaO9PS B1 C1[C@H](n3c
Page 143 and 144: 3767 C26H26O12 methyl 3,5-dicaffeoy
Page 145 and 146: 3812 C26H34O5S 4-hydroxy-5,6-dihydr
Page 147 and 148: 3859 C27H25N3O2 cyclic urea deriv.;
Page 149 and 150: 3900 C27H34BrN3O3 1'-(2-hydroxy-6-m
Page 151 and 152: 3939 C27H36N2O5S2 4-hydroxy-5,6-dih
Page 153 and 154: 3981 C28H31N5O2 1-[(6-benzyloxy-1H-
Page 155 and 156: 4017 C28H36ClN3O6 2-methyl-3-hydrox
Page 157 and 158: 4057 C28H40N8O3S piperidine deriv.;
Page 159 and 160: 4097 C29H37F3N4O4 4098 C29H37NO8 4-
Page 161 and 162: 4136 C29H50N4O11SSi2 4137 C29H51N5O
Page 163 and 164: 4175 C30H41N3O2 5-oxopyrrolidine-3-
Page 165 and 166:
4214 C31H20O6 3,3'-(4-phenylbezylid
Page 167 and 168:
4255 C31H39N5O7 4256 C31H39N5O8 1-[
Page 169 and 170:
N-3-benzoyloxymethyl / N-3-carboxym
Page 171 and 172:
4332 C32H37IN2O TAK-779 derivative;
Page 173 and 174:
4374 C32H44O8 cucurbitacin E CC1(C)
Page 175 and 176:
4411 C33H22O8 3,3'-(4-stilbenomethy
Page 177 and 178:
4452 C33H37Cl2N3O2 5-oxopyrrolidine
Page 179 and 180:
4491 C33H40N2O7 N-(2(R)-hydroxy-1(S
Page 181 and 182:
4528 C33H53NO4 betulinic acid deriv
Page 183 and 184:
4569 C34H40ClN3O5 2-methyl-3-hydrox
Page 185 and 186:
4609 C34H51N5O8 hydroxyethylhydrazi
Page 187 and 188:
4647 C35H38N2O3 cyclic urea deriv.;
Page 189 and 190:
4685 C35H46O9 phorbol deriv.; T-422
Page 191 and 192:
4723 C36H38N2O6S cyclic sulfondiami
Page 193 and 194:
4761 C36H55NO6 triterpene acid / he
Page 195 and 196:
Page 197 and 198:
4837 C37H58O6 3-(3,3-dimethyl-1,5-p
Page 199 and 200:
4873 C38H47N5O7S tripeptide deriv.;
Page 201 and 202:
4909 C38H63NO4 betulinic acid deriv
Page 203 and 204:
4942 C39H53N7O7 hydroxyethylhydrazi
Page 205 and 206:
4977 C40H53N5O8 meta-/paracyclophan
Page 207 and 208:
Page 209 and 210:
5043 C42H52N6O8 L-mannaric acid dia
Page 211 and 212:
5075 C43H61N5O8 HIV protease inhibi
Page 213 and 214:
Page 215 and 216:
5138 C47H46N6O5 SB-570 5139 C47H46N
Page 217 and 218:
5168 C48H82N2O5 betulinic acid deri
Page 219 and 220:
5196 C55H81N5O14 Indinavir-PEG350(8
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TerraTox - HIV-1 structure file, May 2004. Copyright ... - TerraBase Inc.

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