| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 12 | No |
Popular Name: (4R)-4-(3-aminopropyl)-2,5-dimethyl-4H-pyrazol-3-one (4R)-4-(3-aminopropyl)-2,5-dimet…
| 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) | -0.06 | -1.04 | -48.8 | 4 | 4 | 1 | 66 | 170.236 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.52 | 0.99 | -50.46 | 4 | 4 | 1 | 65 | 170.236 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
