| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 29 | No |
Popular Name: 1-(2-morpholinoethyl)-1-(3-pyridylmethyl)-3-[2-(trifluoromethyl)phenyl]thiourea 1-(2-morpholinoethyl)-1-(3-pyrid…
| 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) | 2.48 | 9.16 | -12.43 | 1 | 5 | 0 | 41 | 424.492 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.48 | 11.43 | -45.81 | 2 | 5 | 1 | 42 | 425.5 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 2.48 | 11.9 | -108.53 | 3 | 5 | 2 | 43 | 426.508 | 9 | ↓ |
