UCSF

ZINC32103829

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2009 17 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) 1.50 2.33 -6.55 2 3 0 45 248.351 5
Lo Low (pH 4.5-6) 1.50 2.77 -36.37 3 3 1 46 249.359 5

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