UCSF

ZINC37336466

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2009 19 No

Download: MOL2 SDF SMILES Flexibase

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) 3.03 9.26 -45.03 1 5 1 67 265.333 7
Hi High (pH 8-9.5) 3.03 7.95 -8.72 0 5 0 66 264.325 7

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Rings

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