In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2009 | 21 | Yes |
Popular Name: 2-[1-[[(1-aminocyclohexanecarbonyl)amino]methyl]cyclohexyl]acetic 2-[1-[[(1-aminocyclohexanecarbon…
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) | 2.31 | 5.27 | -82.04 | 4 | 5 | 0 | 97 | 296.411 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 5.35 | -54.59 | 3 | 5 | -1 | 95 | 295.403 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.31 | 3.28 | -53.91 | 5 | 5 | 1 | 94 | 297.419 | 5 | ↓ |