In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 25 | No |
Popular Name: 1-[[(1R,3S)-1-(dimethylamino)-3-methyl-cyclohexyl]methyl]-3-(4-methyl-3-nitro-phenyl)urea 1-[[(1R,3S)-1-(dimethylamino)-3-…
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) | 3.79 | 8.81 | -46.63 | 3 | 7 | 1 | 91 | 349.455 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.