In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2010 | 23 | Yes |
Popular Name: 1-[2-(N-ethyl-2-methyl-anilino)ethyl]-3-(4-pyridylmethyl)urea 1-[2-(N-ethyl-2-methyl-anilino)e…
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) | 2.36 | 7.04 | -9.94 | 2 | 5 | 0 | 57 | 312.417 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 6.69 | -42.3 | 3 | 5 | 1 | 58 | 313.425 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.36 | 7.15 | -86.51 | 4 | 5 | 2 | 60 | 314.433 | 7 | ↓ |