In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 24 | Yes |
Popular Name: 1-[4-(difluoromethoxy)phenyl]-3-[[(2S)-1-(2-methoxyethyl)pyrrolidin-2-yl]methyl]urea 1-[4-(difluoromethoxy)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) | 2.46 | 5.37 | -44.87 | 3 | 6 | 1 | 64 | 344.382 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.46 | 3.1 | -13.25 | 2 | 6 | 0 | 63 | 343.374 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.