UCSF

ZINC39917701

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 29 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) 5.49 14.88 -47.99 1 4 1 31 412.985 9
Mid Mid (pH 6-8) 5.49 15.19 -98.03 2 4 2 33 413.993 9

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