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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03460364

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TBATETRABUTYLAMMONIUM IONI,L2BOB0.77
TBATETRABUTYLAMMONIUM IONA,C2DWD0.77
TBATETRABUTYLAMMONIUM IONA,C2HVJ0.77
TBATETRABUTYLAMMONIUM IONC2DWE0.77
TBATETRABUTYLAMMONIUM IONA,B1J950.77
TBATETRABUTYLAMMONIUM IONA,C2HVK0.77
TBATETRABUTYLAMMONIUM IONA1JVM0.77
TBATETRABUTYLAMMONIUM IONC2HJF0.77
DMEDECAMETHONIUM IONA,B,C,D1MAA1
DMEDECAMETHONIUM IONA1ACL1
16ACETYL-TRIMETHYL-AMMONIUMA3HF00.97
16ACETYL-TRIMETHYL-AMMONIUMA,B,C,D1KPG0.97
16ACETYL-TRIMETHYL-AMMONIUMA1TPY0.97
DETUNDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B,D,E,G,H,
J,K
1LGH0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HG30.79
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,R,S1S000.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA3C1H0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2GNU0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2R4P0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RGN0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1R2C0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DU30.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2BOZ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1K6L0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1T160.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1FNP0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2R4O0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWU0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HG90.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2JIY0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C2R4L0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1GZM0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DSY0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2J8C0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1F7S0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B3DWN0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2GMR0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M,U1DXR0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M1MPS0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UXL0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RZH0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D3DWK0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M2JBL0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M6PRC0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B3HB30.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWT0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1UMX0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RG50.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C2F1T0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1AR10.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M7PRC0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2IWW0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2J8D0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1VRN0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1YIV0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2R4N0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,D3EHB0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DTR0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1C8U0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M,R,S,T1DS80.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1T1L0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1THQ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1FNQ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UXJ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D3BEH0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1KMO0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1L9B0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA2Z760.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HJ60.79
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M1PCR0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M2I5N0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DTA0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC1E140.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1SQC0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UX50.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DTS0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1K6N0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA3C1I0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M1YF60.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C2GVM0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1PRC0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UX30.79
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,R,S1RZZ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DUQ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M,R,S,T1DV60.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M3PRC0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWW0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWV0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RQK0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1XKW0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M2PRC0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UX40.79
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,R,S1AIJ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HHK0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1F6N0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M5PRC0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1KMP0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D2IWV0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D,E,F,
G,H,I,L
1OJD0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HIT0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M,R,S,T1DV30.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA2HDI0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2IRV0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,R,S
2FKW0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DU20.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,D,L,M,R,S1L9J0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA3C9L0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,X2UXM0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC1E6D0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RVJ0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA2I2Q0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RY50.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2VQI0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1EYS0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWS0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HH10.79
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UXK0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M3D380.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA1UJW0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEA2GSK0.79
LDALAURYL DIMETHYLAMINE-N-OXIDEP1SKN0.79
10ADIDECYL-DIMETHYL-AMMONIUMA,B,C,D1KPH0.93
10ADIDECYL-DIMETHYL-AMMONIUMA1KPI0.93
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B,C,D,E,F1GVM0.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA2PRL0.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1D3G0.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B,C,D2F6M0.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1QFF0.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEX1W520.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1FI10.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B1HCX0.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA2PRH0.79
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1QFG0.79
CATDODECANE-TRIMETHYLAMINEA,B2SHP0.93