In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2011 | 21 | Yes |
Popular Name: 2-methyl-N-[[2-(6-quinolyl)-1H-imidazol-4-yl]methyl]propan-1-amine 2-methyl-N-[[2-(6-quinolyl)-1H-i…
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) | 2.94 | 7.54 | -43.48 | 3 | 4 | 1 | 58 | 281.383 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.94 | 6.31 | -8.97 | 2 | 4 | 0 | 54 | 280.375 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.