UCSF

ZINC67446626

Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 17 Yes

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Annotations

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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) 2.29 7.64 -26.52 1 3 1 28 235.351 4
Mid Mid (pH 6-8) 2.29 7.72 -6.92 0 3 0 27 234.343 4

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

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