In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2005 | 22 | Yes |
Popular Name: N1,N1-dimethyl-N2-(2-pyridin-4-ylquinolin-4-yl)ethane-1,2-diamine dihydrobromide N1,N1-dimethyl-N2-(2-pyridin-4-y…
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) | 2.66 | 8.11 | -92.32 | 3 | 4 | 2 | 43 | 294.402 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.66 | 5.3 | -8.94 | 1 | 4 | 0 | 41 | 292.386 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 7.78 | -52.01 | 2 | 4 | 1 | 42 | 293.394 | 5 | ↓ |