UCSF

ZINC36221514

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 13 No

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) 0.96 3.59 -23.7 4 4 1 55 179.247 2
Mid Mid (pH 6-8) 0.96 3.14 -6.87 3 4 0 54 178.239 2

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