In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2008 | 30 | Yes |
Popular Name: N-(2-fluorophenyl)-3-[(3R)-1-[[1-(3-pyridyl)pyrrol-2-yl]methyl]-3-piperidyl]propanamide N-(2-fluorophenyl)-3-[(3R)-1-[[1…
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) | 3.61 | 12.58 | -38.59 | 2 | 5 | 1 | 51 | 407.513 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.61 | 12.87 | -103.13 | 3 | 5 | 2 | 53 | 408.521 | 7 | ↓ |