UCSF

ZINC39913854

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2010 35 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 5.52 12.93 -11.06 0 6 0 73 488.971 7
Lo Low (pH 4.5-6) 5.52 13.4 -37.76 1 6 1 74 489.979 7

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