UCSF

ZINC39881741

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 34 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 7.37 16.91 -31.97 1 5 1 53 453.562 6
Mid Mid (pH 6-8) 7.37 16.78 -17.36 0 5 0 52 452.554 6

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