UCSF

ZINC24912318

Substance Information

In ZINC since Heavy atoms Benign functionality
January 22nd, 2009 27 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) 3.33 6.83 -45.34 2 5 1 46 370.448 5
Hi High (pH 8-9.5) 3.33 4.51 -8.61 1 5 0 45 369.44 5

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