UCSF

ZINC71789834

Substance Information

In ZINC since Heavy atoms Benign functionality
February 2nd, 2012 22 Yes

CAS Numbers: 485-71-2 , [485-71-2]

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Annotations

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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) 4.34 10.53 -36.07 1 2 1 17 293.434 3
Lo Low (pH 4.5-6) 4.34 10.96 -91.16 2 2 2 19 294.442 3

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

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