| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 29 | No |
Popular Name: 4-(3-dimethylaminopropylaminomethylene)-2-(4-nitrophenyl)-5-phenyl-pyrazol-3-one 4-(3-dimethylaminopropylaminomet…
| 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) | 3.22 | -0.47 | -43.26 | 1 | 8 | 1 | 95 | 394.455 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 0.9 | -108.97 | 2 | 8 | 2 | 96 | 395.463 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.22 | 0.9 | -108.97 | 2 | 8 | 2 | 96 | 395.463 | 8 | ↓ |
