In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 38 | No |
Popular Name: Imatinib(Piperidine)-N-oxide Imatinib(Piperidine)-N-oxide
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CAS Number: 571186-91-9
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) | 2.59 | 12.72 | -26.47 | 2 | 9 | 0 | 100 | 509.614 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.59 | 13.16 | -63.19 | 3 | 9 | 1 | 101 | 510.622 | 7 | ↓ |