UCSF

ZINC23038202

Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2008 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) 4.58 10.83 -48.09 4 7 1 92 465.961 8
Hi High (pH 8-9.5) 4.58 8.56 -20.69 3 7 0 91 464.953 8

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

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