| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 20 | Yes |
Popular Name: 1-[[(3-isopropyl-1-methyl-pyrazol-4-yl)methylamino]methyl]-N,N-dimethyl-cyclopentanamine 1-[[(3-isopropyl-1-methyl-pyrazo…
| 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) | 2.65 | 7.1 | -34.19 | 2 | 4 | 1 | 34 | 279.452 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.65 | 8.38 | -121.15 | 3 | 4 | 2 | 39 | 280.46 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.65 | 6.27 | -42.24 | 2 | 4 | 1 | 38 | 279.452 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
