nAChRalpha5

Reference Set (50 Compounds)

$CN/C(=N\[N+](=O)[O-])NCc1cnc(Cl)s1 ZINC000013827936$

ZINC000013827936 (search)

O=[N+]([O-])/N=C1/NCCN1Cc1ccc(Cl)nc1 ZINC000004474604

ZINC000004474604 (search)

$CN1CCN(Cc2cnc(Cl)s2)/C(=N\C#N)C1=O ZINC000103190401$

ZINC000103190401 (search)

CN1CCN(Cc2ccc(Cl)nc2)/C(=N/C#N)C1=O ZINC000103188658

ZINC000103188658 (search)

$CN/C(=N\[N+](=O)[O-])NCc1ccc(Cl)nc1 ZINC000013835804$

ZINC000013835804 (search)

$O=[N+]([O-])/N=C1\NCCN1Cc1cnc(Cl)s1 ZINC000031502165$

ZINC000031502165 (search)

$O=[N+]([O-])/N=C1\NCOCN1Cc1ccc(Cl)nc1 ZINC000103290939$

ZINC000103290939 (search)

$O=[N+]([O-])/N=C1\NCOCN1Cc1cnc(Cl)s1 ZINC000034022409$

ZINC000034022409 (search)

N#CNC1=NCCN1Cc1ccc(Cl)nc1 ZINC000033979097

ZINC000033979097 (search)

$O=[N+]([O-])/N=C1\N(Cc2ccc(Cl)nc2)CCN1Cc1ccc(CN2CCN(Cc3ccc(Cl)nc3)/C2=N\[N+](=O)[O-])o1 ZINC000103222555$

ZINC000103222555 (search)

O=[N+]([O-])/N=C1/NCCN1Cc1cnc(Cl)c(F)c1 ZINC000103288942

ZINC000103288942 (search)

$O=[N+]([O-])/N=C1\NCCN1Cc1cnc(Cl)c(Cl)c1 ZINC000096031302$

ZINC000096031302 (search)

$O=[N+]([O-])/N=C1\N(Cc2ccc(Cl)nc2)CCN1Cc1ccc(CN2CCN(Cc3ccc(Cl)nc3)/C2=N\[N+](=O)[O-])s1 ZINC000103222551$

ZINC000103222551 (search)

$O=[N+]([O-])/N=C1\NCCN1Cc1cnc(Cl)c(Br)c1 ZINC000103185015$

ZINC000103185015 (search)

$C[C@@H](c1ccc(Cl)nc1)N1CCN/C1=N\[N+](=O)[O-] ZINC000103183747$

ZINC000103183747 (search)

$O=[N+]([O-])/N=C1\NCCN1Cc1cnc(Cl)c([N+](=O)[O-])c1 ZINC000103200070$

ZINC000103200070 (search)

$Cc1cc(CN2CCN/C2=N\[N+](=O)[O-])cnc1Cl ZINC000035837934$

ZINC000035837934 (search)

$O=[N+]([O-])/N=C1\NCCN1Cc1cnc(Cl)c(I)c1 ZINC000103186157$

ZINC000103186157 (search)

O=C1NCCN(Cc2ccc(Cl)nc2)C1=O ZINC000090488071

ZINC000090488071 (search)

N#C/N=C1/NCCN(Cc2ccc(Cl)nc2)C1=O ZINC000103190582

ZINC000103190582 (search)

$CN1CCN(C[C@@H]2CCOC2)/C(=N\C#N)C1=O ZINC000103190393$

ZINC000103190393 (search)

$O=[N+]([O-])/N=C1/N(CCOCCN2CCN(Cc3ccc(Cl)nc3)/C2=N\[N+](=O)[O-])CCN1Cc1ccc(Cl)nc1 ZINC000103220780$

ZINC000103220780 (search)

$O=C1/C(=N\S(=O)(=O)C(F)(F)F)NCCN1Cc1ccc(Cl)nc1 ZINC000103188660$

ZINC000103188660 (search)

$COc1cc(CN2CCN/C2=N\[N+](=O)[O-])cnc1Cl ZINC000103186159$

ZINC000103186159 (search)

$O=[N+]([O-])/N=C1\N(Cc2ccc(Cl)nc2)CCN1Cc1ccccc1-c1ccccc1CN1CCN(Cc2ccc(Cl)nc2)/C1=N\[N+](=O)[O-] ZINC000150571466$

ZINC000150571466 (search)

$N#Cc1cc(CN2CCN/C2=N\[N+](=O)[O-])cnc1Cl ZINC000103200069$

ZINC000103200069 (search)

$C[C@H](c1ccc(Cl)nc1)N1CCN/C1=N\[N+](=O)[O-] ZINC000103183750$

ZINC000103183750 (search)

O=c1cccc2n1C[C@@H]1CNC[C@H]2C1 ZINC000001599730

ZINC000001599730 (search)

Clc1ccc([C@H]2C[C@@H]3CC[C@H]2N3)cn1 ZINC000000402872

ZINC000000402872 (search)

$CC(C)(CCN1CCN(Cc2ccc(Cl)nc2)/C1=N\[N+](=O)[O-])CCN1CCN(Cc2ccc(Cl)nc2)/C1=N\[N+](=O)[O-] ZINC000103220777$

ZINC000103220777 (search)

$CO/N=C1\NCCN(Cc2ccc(Cl)nc2)C1=O ZINC000034544242$

ZINC000034544242 (search)

$O=C(CN1CCN(Cc2ccc(Cl)nc2)/C1=N\[N+](=O)[O-])OCCOC(=O)CN1CCN(Cc2ccc(Cl)nc2)/C1=N\[N+](=O)[O-] ZINC000150575030$

ZINC000150575030 (search)

O=C1C(=S)NCCN1Cc1ccc(Cl)nc1 ZINC000103190404

ZINC000103190404 (search)

COc1cc2c3cc1Oc1cc(ccc1O)C[C@@H]1c4c(cc(OC)c(O)c4Oc4ccc(cc4)C[C@@H]3N(C)CC2)CC[N+]1(C)C ZINC000003978083

ZINC000003978083 (search)

ZINC000100079004 (search)

$O=[N+]([O-])/N=C1/N(Cc2ccc(CN3CCN(Cc4ccc(Cl)nc4)/C3=N\[N+](=O)[O-])cc2)CCN1Cc1ccc(Cl)nc1 ZINC000044307009$

ZINC000044307009 (search)

$O=[N+]([O-])/N=C1\N(Cc2ccc(Cl)nc2)CCN1Cc1cncc(CN2CCN(Cc3ccc(Cl)nc3)/C2=N\[N+](=O)[O-])c1 ZINC000103222559$

ZINC000103222559 (search)

ZINC000000391812 (search)

$O=[N+]([O-])/N=C1/N(CCCOCCCN2CCN(Cc3ccc(Cl)nc3)/C2=N\[N+](=O)[O-])CCN1Cc1ccc(Cl)nc1 ZINC000103210436$

ZINC000103210436 (search)

O=C1N(Cc2ccccc2)[C@@H]2C[S@@+]3CCC[C@@H]3[C@@H]2N1Cc1ccccc1 ZINC000003831583

ZINC000003831583 (search)

$O=[N+]([O-])/N=C1\N(Cc2ccc(Cl)nc2)CCN1Cc1cccc(CN2CCN(Cc3ccc(Cl)nc3)/C2=N\[N+](=O)[O-])c1 ZINC000103167552$

ZINC000103167552 (search)

Clc1ccc([C@@H]2C[C@H]3CC[C@@H]2N3)cn1 ZINC000000967913

ZINC000000967913 (search)

O=C(/N=C1/N(CCCCCCCN2CCN(Cc3ccc(Cl)nc3)/C2=N/C(=O)C(F)(F)F)CCN1Cc1ccc(Cl)nc1)C(F)(F)F ZINC000150590109

ZINC000150590109 (search)

$O=[N+]([O-])/N=C1\N(CCCCCCN2CCN(Cc3ccc(Cl)nc3)/C2=N/[N+](=O)[O-])CCN1Cc1ccc(Cl)nc1 ZINC000103290548$

ZINC000103290548 (search)

$O=C1/C(=N\O)NCCN1Cc1ccc(Cl)nc1 ZINC000103188663$

ZINC000103188663 (search)

$CN(C)C(=O)/C(=N\C#N)N(C)Cc1ccc(Cl)nc1 ZINC000103190412$

ZINC000103190412 (search)

$NC(=S)N/N=C1\NCCN(Cc2ccc(Cl)nc2)C1=O ZINC000038286831$

ZINC000038286831 (search)

$O=[N+]([O-])/N=C1\N(Cc2ccc(Cl)nc2)CCN1Cc1cccc(CN2CCN(Cc3ccc(Cl)nc3)/C2=N\[N+](=O)[O-])n1 ZINC000103222563$

ZINC000103222563 (search)

$O=[N+]([O-])/N=C1\NCCN1Cc1cnc(Cl)c(-c2ccccc2)c1 ZINC000103200064$

ZINC000103200064 (search)

ZINC000000005898 (search)