| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2011 | 16 | No |
Popular Name: 1-[(3S)-3-(3-methyl-2-thienyl)piperazin-1-yl]prop-2-en-1-one 1-[(3S)-3-(3-methyl-2-thienyl)pi…
| 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) | 1.81 | 3.83 | -9.09 | 1 | 3 | 0 | 32 | 236.34 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.81 | 5.1 | -42.65 | 2 | 3 | 1 | 37 | 237.348 | 2 | ↓ |
