| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 21 | Yes |
Popular Name: (1S)-N-(2-dimethylaminoethyl)-1-(4-isopropylphenyl)-N-propyl-ethane-1,2-diamine (1S)-N-(2-dimethylaminoethyl)-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) | 3.15 | 7.94 | -112.13 | 4 | 3 | 2 | 35 | 293.499 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.15 | 9.68 | -102.85 | 4 | 3 | 2 | 35 | 293.499 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.15 | 5.47 | -45.43 | 3 | 3 | 1 | 34 | 292.491 | 9 | ↓ |
