UCSF

ZINC49237880

Substance Information

In ZINC since Heavy atoms Benign functionality
September 26th, 2010 17 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) 2.52 5.58 -10.69 1 3 0 43 225.295 1
Lo Low (pH 4.5-6) 2.52 7.7 -50.55 2 3 1 44 226.303 1

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