UCSF

ZINC49000908

Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2010 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 2.81 8.4 -50.55 2 4 1 57 274.388 5
Mid Mid (pH 6-8) 2.81 6.41 -16.52 1 4 0 56 273.38 5

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