UCSF

ZINC31933268

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 24 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) 3.14 8.65 -45.16 2 4 1 37 321.448 3
Hi High (pH 8-9.5) 3.14 7.24 -9.75 1 4 0 33 320.44 3
Mid Mid (pH 6-8) 3.14 8.99 -80.76 3 4 2 38 322.456 3

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