UCSF

ZINC40858435

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 25 Yes

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Annotations

Vendors

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) 5.00 10.99 -13.89 1 4 0 51 417.328 5
Hi High (pH 8-9.5) 5.19 8.43 -44.42 0 4 -1 58 416.32 5

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