UCSF

ZINC19433267

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2008 18 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) 1.36 4.59 -9.09 3 5 0 75 248.33 3
Mid Mid (pH 6-8) 1.36 4.86 -36.5 4 5 1 76 249.338 3

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

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