| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 29th, 2008 | 27 | No |
Popular Name: 1-benzyl-1-(3-dimethylaminopropyl)-3-[3-(trifluoromethyl)phenyl]thiourea 1-benzyl-1-(3-dimethylaminopropy…
| 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) | 4.16 | 14.36 | -46.99 | 2 | 3 | 1 | 20 | 396.502 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 14.01 | -47.11 | 1 | 3 | 0 | 20 | 395.494 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.84 | 13.54 | -55.24 | 1 | 3 | 0 | 20 | 395.494 | 9 | ↓ |
