In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 3rd, 2009 | 23 | Yes |
Popular Name: cyclohexanecarboxylic acid, 2-[[[4-[2-(methylamino)-2-oxoethyl]phenyl]amino]carbonyl]- cyclohexanecarboxylic acid, 2-[[…
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) | 1.80 | 5.9 | -78.1 | 2 | 6 | -1 | 98 | 317.365 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.80 | 4.77 | -25.29 | 3 | 6 | 0 | 95 | 318.373 | 5 | ↓ |