| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 21 | No |
Popular Name: 3-[[3-(chloromethyl)-2-quinolyl]-isobutyl-amino]propanenitrile 3-[[3-(chloromethyl)-2-quinolyl]…
| 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) | 3.47 | 11.27 | -10.88 | 0 | 3 | 0 | 40 | 301.821 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.47 | 11.95 | -34.31 | 1 | 3 | 1 | 41 | 302.829 | 6 | ↓ |
