UCSF

ZINC40507259

Substance Information

In ZINC since Heavy atoms Benign functionality
April 8th, 2010 16 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) 2.22 4.84 -5.22 1 4 0 48 231.336 10
Mid Mid (pH 6-8) 2.22 6.17 -38.85 2 4 1 52 232.344 10

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