| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 16 | Yes |
Popular Name: 4-(aminomethyl)-N-(cyclobutylmethyl)-N,2,5-trimethyl-pyrazol-3-amine 4-(aminomethyl)-N-(cyclobutylmet…
| 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) | 0.99 | 5.08 | -45.02 | 3 | 4 | 1 | 49 | 223.344 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 4.68 | -5.19 | 2 | 4 | 0 | 47 | 222.336 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.99 | 4.81 | -23.9 | 3 | 4 | 1 | 48 | 223.344 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.99 | 5.21 | -98.65 | 4 | 4 | 2 | 50 | 224.352 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
