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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03275261

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CATDODECANE-TRIMETHYLAMINEA,B2SHP0.87
TBATETRABUTYLAMMONIUM IONI,L2BOB0.72
TBATETRABUTYLAMMONIUM IONA,C2DWD0.72
TBATETRABUTYLAMMONIUM IONA,C2HVJ0.72
TBATETRABUTYLAMMONIUM IONC2DWE0.72
TBATETRABUTYLAMMONIUM IONA,B1J950.72
TBATETRABUTYLAMMONIUM IONA,C2HVK0.72
TBATETRABUTYLAMMONIUM IONA1JVM0.72
TBATETRABUTYLAMMONIUM IONC2HJF0.72
10ADIDECYL-DIMETHYL-AMMONIUMA,B,C,D1KPH0.88
10ADIDECYL-DIMETHYL-AMMONIUMA1KPI0.88
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B,C,D,E,F1GVM0.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA2PRL0.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1D3G0.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B,C,D2F6M0.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1QFF0.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEX1W520.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1FI10.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B1HCX0.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA2PRH0.74
DDQDECYLAMINE-N,N-DIMETHYL-N-OXIDEA1QFG0.74
DETUNDECYLAMINE-N,N-DIMETHYL-N-OXIDEA,B,D,E,G,H,
J,K
1LGH0.74
16ACETYL-TRIMETHYL-AMMONIUMA3HF00.9
16ACETYL-TRIMETHYL-AMMONIUMA,B,C,D1KPG0.9
16ACETYL-TRIMETHYL-AMMONIUMA1TPY0.9
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HG30.74
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,R,S1S000.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA3C1H0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2GNU0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2R4P0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RGN0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1R2C0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DU30.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2BOZ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1K6L0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1T160.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1FNP0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2R4O0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWU0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HG90.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2JIY0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C2R4L0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1GZM0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DSY0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2J8C0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1F7S0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B3DWN0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2GMR0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M,U1DXR0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M1MPS0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UXL0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RZH0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D3DWK0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M2JBL0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M6PRC0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B3HB30.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWT0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1UMX0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RG50.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C2F1T0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1AR10.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M7PRC0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2IWW0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2J8D0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1VRN0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1YIV0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2R4N0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,D3EHB0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DTR0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1C8U0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M,R,S,T1DS80.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B1T1L0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1THQ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1FNQ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UXJ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D3BEH0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1KMO0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1L9B0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA2Z760.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HJ60.74
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M1PCR0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M2I5N0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DTA0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC1E140.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1SQC0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UX50.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DTS0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1K6N0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA3C1I0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M1YF60.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C2GVM0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1PRC0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UX30.74
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,R,S1RZZ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DUQ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M,R,S,T1DV60.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M3PRC0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWW0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWV0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RQK0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1XKW0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M2PRC0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UX40.74
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,R,S1AIJ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HHK0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1F6N0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M5PRC0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1KMP0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D2IWV0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D,E,F,
G,H,I,L
1OJD0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HIT0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M,R,S,T1DV30.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA2HDI0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2IRV0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,R,S
2FKW0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M3DU20.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,D,L,M,R,S1L9J0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA3C9L0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEL,M,X2UXM0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC1E6D0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RVJ0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA2I2Q0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M1RY50.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA,B2VQI0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M1EYS0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UWS0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2HH10.74
LDALAURYL DIMETHYLAMINE-N-OXIDEH,L,M2UXK0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEC,H,L,M3D380.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA1UJW0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEA2GSK0.74
LDALAURYL DIMETHYLAMINE-N-OXIDEP1SKN0.74
DMEDECAMETHONIUM IONA,B,C,D1MAA0.88
DMEDECAMETHONIUM IONA1ACL0.88