UCSF

ZINC40190454

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 26 Yes

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Annotations

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) 3.52 9.44 -9.98 1 5 0 56 349.434 6
Lo Low (pH 4.5-6) 3.52 9.88 -28.65 2 5 1 57 350.442 6

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