UCSF

ZINC39885363

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 28 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) 5.88 11.88 -20.03 1 5 0 64 454.404 7
Mid Mid (pH 6-8) 6.06 9.87 -47.74 0 5 -1 70 453.396 7

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