| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2009 | 17 | Yes |
Popular Name: (3R)-3-[[(1R)-4-(diethylamino)-1-methyl-butyl]amino]pentanenitrile (3R)-3-[[(1R)-4-(diethylamino)-1…
| 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) | 2.07 | 8.58 | -104 | 3 | 3 | 2 | 45 | 241.423 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.07 | 7.57 | -40.94 | 2 | 3 | 1 | 40 | 240.415 | 10 | ↓ |
