UCSF

ZINC39222528

Substance Information

In ZINC since Heavy atoms Benign functionality
February 9th, 2010 12 No

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Annotations

Vendors

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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) 2.34 5.19 -3.9 2 2 0 29 162.236 0
Lo Low (pH 4.5-6) 2.34 5.01 -41.07 3 2 1 31 163.244 0

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