| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 21 | Yes |
Popular Name: N-[(1S)-1-(2,5-dimethyl-3-thienyl)ethyl]-2-methyl-2-(4-methylpiperazin-1-yl)propan-1-amine N-[(1S)-1-(2,5-dimethyl-3-thieny…
| 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) | 2.82 | 9.04 | -96.41 | 3 | 3 | 2 | 24 | 311.539 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 8.45 | -120.05 | 3 | 3 | 2 | 24 | 311.539 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 7.33 | -31.24 | 2 | 3 | 1 | 20 | 310.531 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 6.56 | -37.48 | 2 | 3 | 1 | 23 | 310.531 | 5 | ↓ |
