UCSF

ZINC38827988

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2010 33 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) 4.93 11.79 -15.43 0 6 0 65 479.627 8
Lo Low (pH 4.5-6) 4.93 11.68 -45.93 1 6 1 66 480.635 8

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