UCSF

ZINC39889882

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 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) 4.88 13.2 -20.2 0 7 0 84 485.927 3
Lo Low (pH 4.5-6) 4.88 13.86 -35.12 1 7 1 85 486.935 3

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