In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 34 | Yes |
Popular Name: 3-[[2-amino-6-(3-methoxyanilino)pyrimidin-4-yl]amino]-N,N-diisobutyl-benzamide 3-[[2-amino-6-(3-methoxyanilino)…
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) | 5.49 | 13.37 | -13.27 | 4 | 8 | 0 | 105 | 462.598 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.49 | 14 | -35.34 | 5 | 8 | 1 | 107 | 463.606 | 10 | ↓ |
Mid Mid (pH 6-8) | 5.49 | 13.37 | -35.63 | 5 | 8 | 1 | 107 | 463.606 | 10 | ↓ |