| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2006 | 27 | No |
Popular Name: 3-(2-chloro-5-methyl-phenyl)-1-(3-imidazol-1-ylpropyl)-1-(4-pyridylmethyl)thiourea 3-(2-chloro-5-methyl-phenyl)-1-(…
| 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) | 2.71 | 14.61 | -46.2 | 2 | 5 | 1 | 47 | 400.959 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.71 | 14.1 | -18.41 | 1 | 5 | 0 | 46 | 399.951 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.71 | 15.07 | -95.24 | 3 | 5 | 2 | 48 | 401.967 | 9 | ↓ |
