UCSF

ZINC38577449

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 24 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) 1.78 8.2 -40.83 1 5 1 45 346.476 3
Mid Mid (pH 6-8) 1.78 5.84 -12.24 0 5 0 44 345.468 3

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

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