In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 16 | No |
Popular Name: 1-(3-Nitro-pyridin-2-yl)-[1,4]diazepane 1-(3-Nitro-pyridin-2-yl)-[1,4]di…
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CAS Numbers: 1177274-85-9 , 147539-29-5 , N/A
1-(3-nitro-2-pyridyl)-1,4-diazepane
1-(3-nitropyridin-2-yl)-1,4-diazepane
1-(3-Nitropyridin-2-yl)-1,4-diazepane diHCl
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) | 0.62 | 6.13 | -44.28 | 2 | 6 | 1 | 79 | 223.256 | 2 | ↓ |