| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2008 | 26 | No |
Popular Name: 4-[(cyclopropylimino)methyl]-2-{4-nitrophenyl}-5-phenyl-1,2-dihydro-3H-pyrazol-3-one 4-[(cyclopropylimino)methyl]-2-{…
| 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) | 2.87 | 9.8 | -39.91 | 2 | 7 | 1 | 98 | 349.37 | 5 | ↓ |
| Ref Reference (pH 7) | 2.87 | 10.38 | -38.7 | 2 | 7 | 1 | 98 | 349.37 | 5 | ↓ |
| Ref Reference (pH 7) | 2.81 | 10.2 | -15.02 | 1 | 7 | 0 | 93 | 348.362 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.87 | 9.44 | -17.72 | 1 | 7 | 0 | 96 | 348.362 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.87 | 8.84 | -14.23 | 1 | 7 | 0 | 96 | 348.362 | 5 | ↓ |
