UCSF

ZINC31892364

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 23 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) 4.87 11.33 -78 1 4 0 54 319.445 12
Hi High (pH 8-9.5) 4.87 8.97 -51.22 0 4 -1 53 318.437 12

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