In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 29 | Yes |
Popular Name: 2-[3-[[4-(1H-indazol-4-ylamino)pyrimidin-2-yl]amino]phenoxy]-N-methyl-acetamide 2-[3-[[4-(1H-indazol-4-ylamino)p…
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) | 3.22 | 8.64 | -21.15 | 4 | 9 | 0 | 117 | 389.419 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.22 | 8.41 | -44.08 | 5 | 9 | 1 | 118 | 390.427 | 7 | ↓ |