UCSF

ZINC01642186

Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 20 Yes

CAS Numbers: 100896-08-0 , 76932-40-6

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.06 -1.22 -36.18 3 3 0 67 265.312 3

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No pre-computed analogs available. Try a structural similarity search.