In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 20 | Yes |
Popular Name: 3-(3-chlorophenyl)-1-methyl-1-[2-(4-pyridyl)ethyl]urea 3-(3-chlorophenyl)-1-methyl-1-[2…
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) | 2.86 | 7.79 | -13.25 | 1 | 4 | 0 | 45 | 289.766 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.86 | 8.25 | -39.76 | 2 | 4 | 1 | 46 | 290.774 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.