UCSF

ZINC24912279

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2009 32 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) 2.97 6.36 -50.24 3 7 1 69 442.49 3
Mid Mid (pH 6-8) 2.97 4.11 -11.32 2 7 0 68 441.482 3

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