In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 32 | Yes |
Popular Name: N,N-diisobutyl-3-[[2-(3-methylanilino)pyrimidin-4-yl]amino]benzamide N,N-diisobutyl-3-[[2-(3-methylan…
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) | 6.05 | 15.77 | -11.23 | 2 | 6 | 0 | 70 | 431.584 | 9 | ↓ |
Lo Low (pH 4.5-6) | 6.05 | 15.88 | -40.3 | 3 | 6 | 1 | 71 | 432.592 | 9 | ↓ |