UCSF

ZINC54968027

Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2010 17 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) 2.59 7.94 -49.59 0 4 -1 56 271.387 4
Mid Mid (pH 6-8) 2.59 8.28 -39.68 1 4 0 58 272.395 4

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

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