UCSF

ZINC40176704

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 27 Yes

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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) 3.64 3.9 -12.85 2 7 0 96 455.33 4
Hi High (pH 8-9.5) 3.64 4.91 -50.27 1 7 -1 99 454.322 4

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