In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2010 | 24 | Yes |
Popular Name: 1-[1-[(1-methylimidazol-2-yl)methyl]piperidine-4-carbonyl]piperidine-4-carboxamide 1-[1-[(1-methylimidazol-2-yl)met…
None
None
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) | -0.47 | 3.54 | -40.99 | 3 | 7 | 1 | 86 | 334.444 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.47 | 2.86 | -21.54 | 2 | 7 | 0 | 84 | 333.436 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.47 | 5.1 | -54.14 | 3 | 7 | 1 | 86 | 334.444 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.47 | 5.76 | -118.29 | 4 | 7 | 2 | 87 | 335.452 | 4 | ↓ |