UCSF

ZINC10327024

Substance Information

In ZINC since Heavy atoms Benign functionality
September 27th, 2007 18 No

Download: MOL2 SDF SMILES Flexibase

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) -0.41 1.26 -8.3 2 6 0 84 245.238 4
Lo Low (pH 4.5-6) -0.41 1.54 -37.25 3 6 1 85 246.246 4

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

No pre-computed analogs available. Try a structural similarity search.