In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 8th, 2009 | 22 | Yes |
Popular Name: N-[(4-imidazol-1-ylphenyl)methyl]-1-isopropyl-piperidin-4-amine N-[(4-imidazol-1-ylphenyl)methyl…
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) | 1.92 | 9.87 | -38.53 | 2 | 4 | 1 | 34 | 299.442 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 8.71 | -50.92 | 2 | 4 | 1 | 38 | 299.442 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 10.38 | -71.65 | 3 | 4 | 2 | 36 | 300.45 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 11.45 | -167.06 | 4 | 4 | 3 | 40 | 301.458 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 9.19 | -90.6 | 3 | 4 | 2 | 39 | 300.45 | 5 | ↓ |