| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2008 | 31 | No |
Popular Name: 3-[4-chloro-3-(trifluoromethyl)phenyl]-1-(3-morpholinopropyl)-1-(4-pyridylmethyl)thiourea 3-[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) | 3.35 | 10.12 | -17.24 | 1 | 5 | 0 | 41 | 472.964 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.35 | 12.45 | -54.58 | 2 | 5 | 1 | 42 | 473.972 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.35 | 12.89 | -108.77 | 3 | 5 | 2 | 43 | 474.98 | 10 | ↓ |
