| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 15th, 2009 | 25 | Yes |
Popular Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[4-(2-methoxyethyl)piperazin-1-yl]acetamide N-[4-chloro-3-(trifluoromethyl)p…
| 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) | 2.89 | 5.69 | -38.77 | 2 | 5 | 1 | 46 | 380.818 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.89 | 3.42 | -10.99 | 1 | 5 | 0 | 45 | 379.81 | 7 | ↓ |
Popular Name: 4-chloro-N-(2-morpholinoethyl)-3-(trifluoromethyl)aniline 4-chloro-N-(2-morpholinoethyl)-3…
| 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) | 3.17 | 4.01 | -6.11 | 1 | 3 | 0 | 24 | 308.731 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 6.34 | -49.28 | 2 | 3 | 1 | 26 | 309.739 | 5 | ↓ |
