UCSF

ZINC52825240

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 25 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) 1.91 8.31 -48.66 2 6 1 78 347.414 7
Mid Mid (pH 6-8) 1.91 6.16 -12.6 1 6 0 76 346.406 7

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

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