| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 20 | Yes |
Popular Name: (1S)-N-(2-dimethylaminoethyl)-1-(3,4-dimethylphenyl)-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) | 2.46 | 6.68 | -112.53 | 4 | 3 | 2 | 35 | 279.472 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.46 | 8.08 | -105.62 | 4 | 3 | 2 | 35 | 279.472 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.46 | 4.22 | -42.7 | 3 | 3 | 1 | 34 | 278.464 | 8 | ↓ |
