In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 8th, 2011 | 22 | Yes |
Popular Name: 1-(2-methyl-4-propoxy-phenyl)-3-(3-pyridylmethyl)urea 1-(2-methyl-4-propoxy-phenyl)-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) | 2.92 | 6.02 | -10.32 | 2 | 5 | 0 | 63 | 299.374 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 6.47 | -42.97 | 3 | 5 | 1 | 64 | 300.382 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.