UCSF

ZINC59321698

Substance Information

In ZINC since Heavy atoms Benign functionality
March 2nd, 2011 19 No

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Annotations

Vendors

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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) 4.82 8.96 -117.47 4 2 2 32 270.505 10
Hi High (pH 8-9.5) 4.82 7.06 -40.23 3 2 1 31 269.497 10
Mid Mid (pH 6-8) 4.82 8.52 -26.06 3 2 1 30 269.497 10

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