| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 1st, 2011 | 27 | Yes |
Popular Name: N-[3-[isopropyl(methyl)amino]propyl]-5-methyl-1-(5-quinolyl)triazole-4-carboxamide N-[3-[isopropyl(methyl)amino]pro…
| 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) | 2.23 | 7.55 | -42.19 | 2 | 7 | 1 | 77 | 367.477 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.23 | 7.97 | -80.71 | 3 | 7 | 2 | 78 | 368.485 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
