UCSF

ZINC38829593

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2010 26 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) 2.04 10 -50.11 1 6 1 55 370.864 2
Mid Mid (pH 6-8) 2.04 7.64 -9.33 0 6 0 54 369.856 2

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