UCSF

ZINC06015294

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2006 32 No

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

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Other Names:

MFCD01367242

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Annotations

None

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) 6.70 14.2 -7.1 0 4 0 56 494.429 6 ↓
Mid Mid (pH 6-8) 6.88 13.98 -8.29 0 4 0 56 494.429 6 ↓
Mid Mid (pH 6-8) 6.88 14.82 -15.39 0 4 0 56 494.429 6 ↓
Mid Mid (pH 6-8) 6.70 14.19 -10.49 0 4 0 56 494.429 6 ↓

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