In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 19 | Yes |
Popular Name: 2-{[(4-chlorophenyl)amino]carbonyl}cyclohexanecarboxylic acid 2-{[(4-chlorophenyl)amino]carbon…
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CAS Number: 101937-67-1
2-((4-Chlorophenyl)carbamoyl)cyclohexanecarboxylic acid
2-([(4-Chlorophenyl)amino]carbonyl)cyclohexanecarboxylic acid
2-[(4-chloroanilino)carbonyl]cyclohexanecarboxylic acid
2-[(4-Chlorophenyl)carbamoyl]cyclohexane-1-carboxylic acid
2-{[(4-Chlorophenyl)amino]-carbonyl}cyclohexanecarboxylic acid
CHLOROPHENYLAMINOCARBONYLCYCLOHEXANECARBOXYLICACI
cyclohexanecarboxylic acid, 2-[[(4-chlorophenyl)amino]carbonyl]-
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) | 3.19 | 7.58 | -59.37 | 1 | 4 | -1 | 69 | 280.731 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.19 | 6.18 | -12.02 | 2 | 4 | 0 | 66 | 281.739 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.