UCSF

ZINC41057054

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2010 23 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) 4.42 8.95 -13.92 1 4 0 51 306.365 3
Lo Low (pH 4.5-6) 4.42 9.31 -31.18 2 4 1 52 307.373 3
Lo Low (pH 4.5-6) 4.60 9.43 -29.44 2 4 1 56 307.373 2

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