UCSF

ZINC40232863

Substance Information

In ZINC since Heavy atoms Benign functionality
April 4th, 2010 27 Yes

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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) 6.74 12.58 -10.2 0 3 0 27 417.723 5
Lo Low (pH 4.5-6) 6.74 13.17 -22.85 1 3 1 28 418.731 5

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

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