In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 38 | No |
Popular Name: Imatinib(Pyridine)-N-oxide Imatinib(Pyridine)-N-oxide
Find On: PubMed — Wikipedia — Google
CAS Number: 571186-92-0
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) | 2.48 | 13.59 | -60.43 | 3 | 9 | 1 | 100 | 510.622 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 13.46 | -64.97 | 3 | 9 | 1 | 100 | 510.622 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.48 | 11.13 | -27.1 | 2 | 9 | 0 | 99 | 509.614 | 7 | ↓ |