| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 3rd, 2010 | 21 | Yes |
Popular Name: (2S)-2-[2-dimethylaminoethyl(propyl)amino]-1-(4-ethylphenyl)propan-1-one (2S)-2-[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) | 3.64 | 9.38 | -33.14 | 1 | 3 | 1 | 25 | 291.459 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 8.91 | -33.92 | 1 | 3 | 1 | 25 | 291.459 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 6.89 | -6.53 | 0 | 3 | 0 | 24 | 290.451 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.64 | 11.37 | -111.71 | 2 | 3 | 2 | 26 | 292.467 | 9 | ↓ |
