In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 17 | Yes |
Popular Name: N',N'-diisopropyl-N-(4-methyl-2-pyridyl)ethane-1,2-diamine N',N'-diisopropyl-N-(4-methyl-2-…
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) | 2.67 | 7.13 | -34.82 | 2 | 3 | 1 | 29 | 236.383 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 5.23 | -3.62 | 1 | 3 | 0 | 28 | 235.375 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.67 | 7.61 | -84.07 | 3 | 3 | 2 | 31 | 237.391 | 6 | ↓ |