In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 27th, 2010 | 37 | Yes |
Popular Name: N-(1-benzyl-4-piperidyl)-4-[[(1-benzyl-4-piperidyl)amino]methyl]benzamide N-(1-benzyl-4-piperidyl)-4-[[(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) | 4.33 | 16.29 | -178.45 | 5 | 5 | 3 | 55 | 499.723 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.33 | 12.85 | -45.21 | 3 | 5 | 1 | 49 | 497.707 | 9 | ↓ |
Mid Mid (pH 6-8) | 4.33 | 15.1 | -86.95 | 4 | 5 | 2 | 50 | 498.715 | 9 | ↓ |
Lo Low (pH 4.5-6) | 4.33 | 14.06 | -97.26 | 4 | 5 | 2 | 53 | 498.715 | 9 | ↓ |