UCSF

ZINC12008109

Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2008 28 Yes

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Vendors

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) 2.57 9.79 -32.49 2 8 0 106 375.388 4
Mid Mid (pH 6-8) 3.03 9.45 -55.43 1 8 -1 109 374.38 4
Mid Mid (pH 6-8) 2.57 10.61 -15.17 2 8 0 106 375.388 4

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