UCSF

ZINC39789190

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2010 23 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 1.99 4.7 -57.53 3 5 1 59 323.457 6
Hi High (pH 8-9.5) 1.99 6.79 -38.1 3 5 1 58 323.457 6

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Analogs ( Draw Identity 99% 90% 80% 70% )