UCSF

ZINC03628529

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2004 16 Yes

Popular Name: 1-Cyclohexene-1-acetic acid, 4-cyclohexyl-; 4-Cyclohexyl-1-cyclohexene-1-acetic acid; Acetic acid, (4-cyclohexyl-1-cyclohexen-1-yl)-; Acide (cyclohexyl-4 cyclohexen-1 yl) acetique [French]; LS-57385 1-Cyclohexene-1-acetic acid, 4-c…

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Annotations

Vendors

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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) 3.62 9.68 -45.41 0 2 -1 40 221.32 3 ↓
Lo Low (pH 4.5-6) 3.62 7.71 -5.24 1 2 0 37 222.328 3 ↓

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