| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2009 | 33 | Yes |
Popular Name: 1-[(4-tert-butylphenyl)methyl]-1-[2-(2-pyridyl)ethyl]-3-[3-(trifluoromethyl)phenyl]urea 1-[(4-tert-butylphenyl)methyl]-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) | 6.30 | 14.6 | -12.13 | 1 | 4 | 0 | 45 | 455.524 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 6.30 | 14.94 | -52.86 | 2 | 4 | 1 | 46 | 456.532 | 8 | ↓ |
