UCSF

ZINC44114057

Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2010 19 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) 2.37 5.73 -34.58 2 3 1 28 263.405 5
Mid Mid (pH 6-8) 2.37 3.46 -3.82 1 3 0 27 262.397 5

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