UCSF

ZINC24570776

Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2009 33 No

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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) -0.29 6.72 -20.11 2 11 0 135 450.455 5
Hi High (pH 8-9.5) 0.79 5.84 -55.12 1 11 -1 142 449.447 5

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

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