UCSF

ZINC34983936

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 33 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) 0.66 6.35 -74.83 5 7 1 111 451.543 5
Hi High (pH 8-9.5) 0.66 4.61 -31.66 4 7 0 110 450.535 5

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