UCSF

ZINC51529232

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2010 27 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) 2.89 9.52 -13.41 1 5 0 53 363.461 5
Lo Low (pH 4.5-6) 2.89 10.26 -42.78 2 5 0 54 364.469 5

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