UCSF

ZINC40181269

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 31 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) 4.81 12.25 -16.04 1 5 0 60 412.537 8
Lo Low (pH 4.5-6) 4.81 12.51 -38.93 2 5 1 61 413.545 8

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