| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2009 | 30 | No |
Popular Name: 3-[2-chloro-4-(trifluoromethyl)phenyl]-1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)thiourea 3-[2-chloro-4-(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) | 3.16 | 14.94 | -47.41 | 2 | 5 | 1 | 47 | 454.929 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.16 | 14.43 | -18.21 | 1 | 5 | 0 | 46 | 453.921 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.16 | 15.4 | -98.61 | 3 | 5 | 2 | 48 | 455.937 | 10 | ↓ |
