In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 30 | Yes |
Popular Name: 1-[(4-tert-butylphenyl)methyl]-3-(m-tolyl)-1-[2-(2-pyridyl)ethyl]urea 1-[(4-tert-butylphenyl)methyl]-3…
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) | 5.85 | 14.23 | -9.86 | 1 | 4 | 0 | 45 | 401.554 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.85 | 14.58 | -45.9 | 2 | 4 | 1 | 46 | 402.562 | 7 | ↓ |