| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 24 | Yes |
Popular Name: 2,4-diethyl-1-{4-nitrobenzyl}-2,7-dimethyl-1,2-dihydroquinoline 2,4-diethyl-1-{4-nitrobenzyl}-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) | 2.75 | 10.85 | -49.15 | 1 | 5 | 1 | 57 | 319.388 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.75 | 8.61 | -9.48 | 0 | 5 | 0 | 56 | 318.38 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
