| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 2nd, 2009 | 26 | Yes |
Popular Name: 1-[2-methoxy-8-(methylsulfanyl)-10,11-dihydrodibenzo[b,f]thiepin-10-yl]-4-methylpiperazine 1-[2-methoxy-8-(methylsulfanyl)-…
| 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) | 4.17 | 10.86 | -38.34 | 1 | 3 | 1 | 17 | 387.594 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.17 | 8.49 | -5.4 | 0 | 3 | 0 | 16 | 386.586 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.17 | 9.92 | -33.64 | 1 | 3 | 1 | 17 | 387.594 | 3 | ↓ |
