UCSF

ZINC34461580

Substance Information

In ZINC since Heavy atoms Benign functionality
August 30th, 2009 20 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 3.77 10.01 -40.75 1 3 1 21 290.456 4
Hi High (pH 8-9.5) 3.77 8 -6.61 0 3 0 19 289.448 4

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