UCSF

ZINC44263354

Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2010 12 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) 1.33 6.07 -27.19 3 4 1 56 167.236 3
Mid Mid (pH 6-8) 1.33 5.72 -6.43 2 4 0 55 166.228 3

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