UCSF

ZINC38907859

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2010 34 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) 4.30 13.47 -20.55 0 6 0 51 454.574 7
Mid Mid (pH 6-8) 4.30 13.88 -42.31 1 6 1 52 455.582 7
Lo Low (pH 4.5-6) 4.30 15.67 -64.88 1 6 1 52 455.582 7

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