UCSF

ZINC40186329

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 29 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) 1.95 7.87 -18.27 1 7 0 76 392.459 5
Lo Low (pH 4.5-6) 1.95 8.43 -39.5 2 7 1 78 393.467 5

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