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71 SMILES Strings for Adrenergic Alpha

Compound NameSMILES String
BDBM8961 Nc1c2CCCCc2nc2ccccc12
BDBM8903 [H][C@@]12CC[C@H](C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |r,t:20|
BDBM13530 CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
BDBM16173 NC(=N)NC(=O)c1nc(Cl)c(N)nc1N
BDBM17292 [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3CC[C@@]21[H]
BDBM18069 COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OC
BDBM21398 OC1(CCN(CCCC(=O)c2ccc(F)cc2)CC1)c1ccc(Cl)cc1
BDBM23620 OCCN(CCO)c1nc(N2CCCCC2)c2nc(nc(N3CCCCC3)c2n1)N(CCO)CCO
BDBM22889 CNC(NC#N)=NCCSCc1[nH]cnc1C |w:6.6|
BDBM25870 CN(C)CCCC1(OCc2cc(ccc12)C#N)c1ccc(F)cc1
BDBM25761 CC(C)NCC(O)COc1cccc2ccccc12
BDBM29568 COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)c1ccco1
BDBM35229 CNCCCN1c2ccccc2CCc2ccccc12
BDBM36880 Oc1c(Cl)cc(Cl)cc1Sc1cc(Cl)cc(Cl)c1O
BDBM39687 CCN1\C(=C\c2ccc3ccccc3[n+]2CC)C=Cc2ccccc12 |c:19|
BDBM45440 NC(=N)c1ccc(OCCCCCOc2ccc(cc2)C(N)=N)cc1
BDBM48320 CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC
BDBM67545 CN(C)CCCN1c2ccccc2Sc2ccccc12
BDBM67690 OCCNCCNc1ccc(NCCNCCO)c2C(=O)c3c(O)ccc(O)c3C(=O)c12
BDBM78433 OCCN1CCN(CCCN2c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
BDBM78434 CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc23)CC1
BDBM77970 CN(C)CCCN1c2ccccc2CCc2ccc(Cl)cc12
BDBM85330 Cc1nccn1CC1CCc2c(C1=O)c1ccccc1n2C
BDBM85213 [#7]-[#6]-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7]
BDBM87351 COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccccc12
BDBM50000092 CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
BDBM50001955 CN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31 |r|
BDBM50001888 CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc12
BDBM50001915 Clc1cccc(c1)N1CCNCC1
BDBM50004704 COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O |r|
BDBM50010859 CN(C)CCCN1c2ccccc2CCc2ccccc12
BDBM50017679 CC(COc1ccccc1)N(CCCl)Cc1ccccc1
BDBM50017698 CN(C)C(=O)C(CCN1CCC(O)(CC1)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1
BDBM50017696 CC(CN1c2ccccc2Sc2ccccc12)N(C)C
BDBM50016897 Clc1cccc(Cl)c1\[#7]=[#6]-1\[#7]-[#6]-[#6]-[#7]-1
BDBM50020712 [#6]-[#7](-[#6])-[#6]-[#6]\[#6]=[#6]-1/c2ccccc2-[#6]-[#6]-c2ccccc-12
BDBM50028893 CC(C)N(CCC(C(N)=O)(c1ccccc1)c1ccccn1)C(C)C
BDBM50026957 OCCN1CCN(CC\C=C2/c3ccccc3Sc3ccc(cc23)C(F)(F)F)CC1
BDBM50033111 COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C1CCCO1
BDBM50036754 [#7]\[#6](-[#7])=[#7]/c1nc(-[#6]-[#16]-[#6]-[#6]-[#6](=[#7])-[#7]S([#7])(=O)=O)cs1
BDBM50062599 CC12CC3CC(C)(C1)CC(N)(C3)C2 |TLB:7:1:4.5.8:11,10:9:4:2.7.1,0:1:4:8.9.11,THB:7:5:11:2.1.12,12:1:4:8.9.11,12:9:4:2.7.1,6:5:11:2.1.12|
BDBM50062614 CN(C)CCOC(c1ccccc1)c1ccccc1C
BDBM50067133 CCCNCC(O)COc1ccccc1C(=O)CCc1ccccc1
BDBM50079455 C[N+](C)(C)C
BDBM50080092 C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@H]2O |r,t:8|
BDBM50121975 COc1ccc2nccc([C@H](O)[C@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1 |r,THB:20:19:12.13:16.15,10:12:18.19:16.15|
BDBM50128267 CCc1c2Cn3c(cc4c(COC(=O)[C@]4(O)CC)c3=O)-c2nc2ccc(OC(=O)N3CCC(CC3)N3CCCCC3)cc12 |r|
BDBM50149890 CC[N+](CC)(CC)CC
BDBM50153520 CCOc1cc(CC(=O)N[C@@H](CC(C)C)c2ccccc2N2CCCCC2)ccc1C(O)=O |r|
BDBM50151866 Cn1c(NCCN(CCO)CCCc2ccc(cc2)[N+]([O-])=O)cc(=O)n(C)c1=O
BDBM50169808 CC(C)(Cc1c[nH]c2ccccc12)NCC(O)COc1ccccc1C#N
BDBM50170653 C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO |r,t:9|
BDBM50170723 NC(NC(N)=Nc1ccc(Cl)cc1)=NCCCCCCN=C(N)N=C(N)Nc1ccc(Cl)cc1 |w:13.14,20.20,23.23,5.5|
BDBM50176259 COc1cccc(c1)[C@@]1(O)CCCC[C@@H]1CN(C)C
BDBM50229665 [#6]-[#7](-[#6])-[#6](=[#7])\[#7]=[#6](\[#7])-[#7]
BDBM50240370 CC(C)NCC(O)COc1ccccc1OCC=C
BDBM50240410 CC(CN(C)C)CN1c2ccccc2CCc2ccccc12
BDBM50240514 CN(C)CC\C=C1\c2ccccc2Sc2ccc(Cl)cc12
BDBM50240908 NC(=N)N=C(N)NCCc1ccccc1 |w:3.2|
BDBM50252956 COc1ccc(CCNC[C@H](O)c2ccc(O)cc2)cc1OC |r|
BDBM50241342 COc1ccnc(CS(=O)c2nc3ccc(OC(F)F)cc3[nH]2)c1OC
BDBM50253157 CN1CCC[C@@H]1CCO[C@](C)(c1ccccc1)c1ccc(Cl)cc1 |r|
BDBM50248106 Cc1[nH]n(-c2ccc(C)c(C)c2)c(=O)c1N=Nc1cccc(-c2cccc(c2)C(O)=O)c1O |w:16.18|
BDBM50338982 COc1ccc(CCN(C)CCC[C@@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC |r|
BDBM50367247 COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CCN3C[C@@H]4C=C)c2c1 |THB:20:19:12.13:16.15,10:12:19.18:16.15|
BDBM50377964 C[N+]1(C)CCCC(C1)OC(=O)C(O)(c1ccccc1)c1ccccc1
BDBM50403547 CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)c1ccccc1 |r,THB:9:7:1:3.4|
BDBM50416487 CCCC[N+](CCCC)(CCCC)CCCC
BDBM50420217 COc1cc(ccc1O)C(O)CNC(C)C
BDBM50420179 CCC[N+](CCC)(CCC)CCC
BDBM50420232 CN(CCCl)C1c2ccccc2-c2ccccc12