| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2010 | 22 | Yes |
Popular Name: 1-[3-(dimethylaminomethyl)phenyl]-3-[2-(2-pyridyl)ethyl]urea 1-[3-(dimethylaminomethyl)phenyl…
| 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) | 1.86 | 6.74 | -39.04 | 3 | 5 | 1 | 58 | 299.398 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.86 | 4.28 | -14.06 | 2 | 5 | 0 | 57 | 298.39 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.86 | 7.1 | -78.56 | 4 | 5 | 2 | 60 | 300.406 | 6 | ↓ |
