UCSF

ZINC41534137

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 30 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) 2.79 10.27 -71.57 2 6 0 81 409.53 7
Lo Low (pH 4.5-6) 2.79 9.5 -45.67 3 6 1 78 410.538 7

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