UCSF

ZINC41681153

Substance Information

In ZINC since Heavy atoms Benign functionality
April 21st, 2010 19 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) 3.47 7.08 -45.44 4 3 1 42 284.424 7
Hi High (pH 8-9.5) 3.47 4.54 -10.2 3 3 0 41 283.416 7

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Rings

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