UCSF

ZINC39908411

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2010 34 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) 6.95 15.19 -12.89 0 5 0 46 458.602 11
Lo Low (pH 4.5-6) 6.95 15.85 -34.16 1 5 1 47 459.61 11

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