UCSF

ZINC19727306

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 18 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) 0.91 1.71 -57.16 4 4 1 66 250.318 1
Hi High (pH 8-9.5) 0.91 1.12 -7.97 3 4 0 65 249.31 1

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