| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 21 | Yes |
Popular Name: 1-[3-(aminomethyl)-4-quinolyl]-N-methyl-pyrazole-3-carboxamide 1-[3-(aminomethyl)-4-quinolyl]-N…
| 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) | 0.92 | 2.4 | -50.5 | 4 | 6 | 1 | 87 | 282.327 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.92 | 2.09 | -9.77 | 3 | 6 | 0 | 86 | 281.319 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
