| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 20 | Yes |
Popular Name: (2R)-4-[2-dimethylaminoethyl(propyl)amino]-2-(isopropylamino)-2-methyl-butanamide (2R)-4-[2-dimethylaminoethyl(pro…
| 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) | 1.15 | 3.29 | -89.07 | 5 | 5 | 2 | 67 | 288.48 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.15 | 1.6 | -38.48 | 4 | 5 | 1 | 63 | 287.472 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.15 | 1.96 | -36.3 | 4 | 5 | 1 | 63 | 287.472 | 11 | ↓ |
| Hi High (pH 8-9.5) | 1.15 | 0.79 | -43.3 | 4 | 5 | 1 | 66 | 287.472 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 1.15 | 4.12 | -114.21 | 5 | 5 | 2 | 64 | 288.48 | 11 | ↓ |
| Lo Low (pH 4.5-6) | 1.15 | 5.41 | -205.05 | 6 | 5 | 3 | 69 | 289.488 | 11 | ↓ |
