UCSF

ZINC08426813

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 31 No

Popular Name: 2-isopropoxyethyl 4-(6-bromo-1,3-benzodioxol-5-yl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate 2-isopropoxyethyl 4-(6-bromo-1,3…

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Other Names:

MFCD02104467

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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) 4.12 -1.59 -10.04 0 0 0 83 492.366 7 ↓
Mid Mid (pH 6-8) 4.30 -1.59 -11.05 0 7 0 83 492.366 7 ↓
Mid Mid (pH 6-8) 4.30 -0.36 -10.46 0 7 0 83 492.366 7 ↓
Mid Mid (pH 6-8) 4.12 -1.53 -13.38 0 7 0 83 492.366 7 ↓

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