In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2006 | 24 | Yes |
Popular Name: N,N-diethyl-N'-[2-(4-pyridyl)-4-quinolyl]-ethane-1,2-diamine N,N-diethyl-N'-[2-(4-pyridyl)-4-…
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) | 3.42 | 9.15 | -93.26 | 3 | 4 | 2 | 43 | 322.456 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.42 | 9.43 | -168.04 | 4 | 4 | 3 | 45 | 323.464 | 7 | ↓ |