UCSF

ZINC06162247

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 10th, 2006 34 No

Popular Name: propyl 4-(6-bromo-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate propyl 4-(6-bromo-1,3-benzodioxo…

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Other Names:

MFCD00771352

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Annotations

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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) 6.03 -0.18 -8.03 0 6 0 74 524.411 6 ↓
Mid Mid (pH 6-8) 6.03 -0.46 -11.57 0 6 0 74 524.411 6 ↓
Mid Mid (pH 6-8) 6.21 -1.46 -9.69 0 6 0 74 524.411 6 ↓

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