UCSF

ZINC38439449

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2010 21 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) 2.62 6.63 -10.2 0 4 0 45 288.391 7
Mid Mid (pH 6-8) 2.62 8.56 -51.29 1 4 1 47 289.399 7

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