UCSF

ZINC39266327

Substance Information

In ZINC since Heavy atoms Benign functionality
February 11th, 2010 39 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) 3.42 13.18 -82.36 4 8 2 87 539.765 10
Hi High (pH 8-9.5) 3.60 10.84 -49.04 3 8 1 94 538.757 10

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