UCSF

ZINC29931534

Substance Information

In ZINC since Heavy atoms Benign functionality
March 21st, 2009 26 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

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) 1.05 4.15 -14.64 1 8 0 84 362.43 5
Lo Low (pH 4.5-6) 1.05 4.42 -49.4 2 8 1 85 363.438 5

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