UCSF

ZINC33812611

Substance Information

In ZINC since Heavy atoms Benign functionality
July 20th, 2009 36 No

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) 3.41 17.05 -72.63 1 7 1 75 522.72 7
Mid Mid (pH 6-8) 3.41 12.94 -15.84 0 7 0 74 521.712 7

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