In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: 2-(dimethylamino)-N-[4,5-dimethyl-3-(piperazine-1-carbonyl)-2-thienyl]acetamide 2-(dimethylamino)-N-[4,5-dimethy…
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) | 0.09 | 5.17 | -104.26 | 4 | 6 | 2 | 70 | 326.466 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.09 | 1.34 | -11.92 | 2 | 6 | 0 | 65 | 324.45 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.09 | 3.8 | -45.25 | 3 | 6 | 1 | 66 | 325.458 | 4 | ↓ |