UCSF

ZINC40186052

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 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) 4.76 13.31 -19.87 1 6 0 67 452.558 5
Lo Low (pH 4.5-6) 4.76 13.86 -41.14 2 6 1 68 453.566 5

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