UCSF

ZINC59480161

Substance Information

In ZINC since Heavy atoms Benign functionality
March 5th, 2011 24 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) 0.46 9.7 -30.28 2 3 1 43 327.492 3
Mid Mid (pH 6-8) 0.46 9.95 -116.96 3 3 2 45 328.5 3

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