| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2008 | 31 | Yes |
Popular Name: LS-111110 LS-111110
2-[4-(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-1-piperazinyl]ethyl phenyl ether
| 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) | 6.06 | 14.7 | -41.97 | 1 | 3 | 1 | 17 | 452.043 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.06 | 13.86 | -38.77 | 1 | 3 | 1 | 17 | 452.043 | 5 | ↓ |
| Mid Mid (pH 6-8) | 6.06 | 12.34 | -5.74 | 0 | 3 | 0 | 16 | 451.035 | 5 | ↓ |
