In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2011 | 28 | Yes |
Popular Name: 1-[4-(dimethylamino)-2-(trifluoromethyl)phenyl]-3-[3-(N-methylanilino)propyl]urea 1-[4-(dimethylamino)-2-(trifluor…
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) | 4.37 | 9 | -8.65 | 2 | 5 | 0 | 48 | 394.441 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.37 | 9.43 | -26.91 | 3 | 5 | 0 | 49 | 395.449 | 8 | ↓ |