UCSF

ZINC40433877

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 33 No

CAS Number: 496775-61-2

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) 5.15 10.4 -66.76 2 8 -1 120 441.467 5

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