In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2014 | 36 | Yes |
Popular Name: Imatinib Mesylate Imatinib Mesylate
Find On: PubMed — Wikipedia — Google
CAS Number: 220127-57-1
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) | 3.24 | 11.32 | -48.63 | 2 | 7 | 1 | 75 | 479.608 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.24 | 8.95 | -14.24 | 1 | 7 | 0 | 74 | 478.6 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.24 | 11.81 | -96.06 | 3 | 7 | 2 | 77 | 480.616 | 7 | ↓ |
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