In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 9 | Yes |
Popular Name: 4-Pyridinamine, 3-iodo-N-methyl- (9CI) 4-Pyridinamine, 3-iodo-N-methyl-…
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CAS Number: 680859-97-6
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) | 1.74 | 3.17 | -30.38 | 2 | 2 | 1 | 26 | 235.048 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.74 | 2.69 | -3.71 | 1 | 2 | 0 | 25 | 234.04 | 1 | ↓ |