UCSF

ZINC40870889

Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2010 33 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) 7.20 15.63 -14.08 1 4 0 51 497.447 7
Hi High (pH 8-9.5) 7.38 13.08 -43.37 0 4 -1 58 496.439 7

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

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