UCSF

ZINC51554935

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2010 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 1.74 7 -41.11 2 6 1 63 340.488 9
Hi High (pH 8-9.5) 1.74 5 -16.44 1 6 0 62 339.48 9

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