In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 31 | Yes |
Popular Name: 4-[[5-[(4-cyclohexylphenyl)methyl]-4-hydroxy-6-methyl-pyrimidin-2-yl]amino]benzoic 4-[[5-[(4-cyclohexylphenyl)methy…
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) | 6.37 | 14.87 | -52.96 | 2 | 6 | -1 | 98 | 416.501 | 6 | ↓ |
Hi High (pH 8-9.5) | 6.83 | 13.27 | -114.83 | 1 | 6 | -2 | 101 | 415.493 | 6 | ↓ |