In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2009 | 29 | Yes |
Popular Name: 1-(3-fluoro-4-methyl-phenyl)-3-[4-methyl-2-(1-piperidyl)-6-quinolyl]urea 1-(3-fluoro-4-methyl-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) | 5.70 | 10.15 | -36.74 | 3 | 5 | 1 | 59 | 393.486 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.70 | 9.9 | -18.62 | 2 | 5 | 0 | 57 | 392.478 | 3 | ↓ |