UCSF

ZINC04060742

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2005 31 No

Popular Name: butyl 4-(2,4-dimethoxyphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate butyl 4-(2,4-dimethoxyphenyl)-2,…

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Other Names:

MFCD00770932

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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) 5.09 1.72 -9.65 0 6 0 74 427.541 8 ↓
Mid Mid (pH 6-8) 5.27 0.55 -10.77 0 6 0 74 427.541 8 ↓
Mid Mid (pH 6-8) 5.09 1.46 -12.82 0 6 0 74 427.541 8 ↓

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