In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 21 | No |
Popular Name: 9-(4-ethylpiperazin-1-yl)-1,3-dihydrothieno[3,4-b]quinoline 9-(4-ethylpiperazin-1-yl)-1,3-di…
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) | 3.26 | 10.46 | -83.67 | 2 | 3 | 2 | 22 | 301.459 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 8.22 | -26.25 | 1 | 3 | 1 | 21 | 300.451 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 10.08 | -45.27 | 1 | 3 | 1 | 21 | 300.451 | 2 | ↓ |