UCSF

ZINC32801939

Substance Information

In ZINC since Heavy atoms Benign functionality
May 10th, 2009 28 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) 4.59 9.22 -18.26 1 5 0 60 376.456 5
Mid Mid (pH 6-8) 4.59 9.58 -37.38 2 5 1 62 377.464 5

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