In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2006 | 29 | Yes |
Popular Name: 3-[1-(1,4-diazabicyclo[4.3.0]non-4-ylcarbonyl)cyclohexyl]-1-(2,6-dimethylphenyl)-urea 3-[1-(1,4-diazabicyclo[4.3.0]non…
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) | 2.92 | 10.46 | -52.1 | 3 | 6 | 1 | 66 | 399.559 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 8.22 | -15.97 | 2 | 6 | 0 | 65 | 398.551 | 3 | ↓ |