| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2008 | 21 | Yes |
Popular Name: N'-[[3-(4-chlorophenyl)-2H-pyrazol-4-yl]methyl]-N,N-diethyl-ethane-1,2-diamine N'-[[3-(4-chlorophenyl)-2H-pyraz…
| 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) | 2.94 | 7.88 | -37.84 | 3 | 4 | 1 | 45 | 307.849 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 8.26 | -117.33 | 4 | 4 | 2 | 50 | 308.857 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 6.11 | -46.36 | 3 | 4 | 1 | 49 | 307.849 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.94 | 8.25 | -115.33 | 4 | 4 | 2 | 50 | 308.857 | 8 | ↓ |
