UCSF

ZINC41544389

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 33 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) 2.36 11.14 -66.83 1 9 0 124 470.551 7
Lo Low (pH 4.5-6) 2.36 10.39 -56.06 2 9 1 121 471.559 7

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