| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 19 | Yes |
Popular Name: (2S)-3-[(7-chloro-4-quinolyl)-ethyl-amino]-2-methyl-propanenitrile (2S)-3-[(7-chloro-4-quinolyl)-et…
| 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) | 3.84 | 9.37 | -38.34 | 1 | 3 | 1 | 41 | 274.775 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.84 | 8.94 | -8.86 | 0 | 3 | 0 | 40 | 273.767 | 4 | ↓ |
