In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 25 | Yes |
Popular Name: 7-fluoro-11-(4-methyl-1-piperazinyl)-10,11-dihydrodibenzo[b,f]thiepin-2-yl methyl sulfide 7-fluoro-11-(4-methyl-1-piperazi…
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) | 4.28 | 11.77 | -42.55 | 1 | 2 | 1 | 8 | 375.558 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 9.3 | -4.78 | 0 | 2 | 0 | 6 | 374.55 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 10.89 | -38.56 | 1 | 2 | 1 | 8 | 375.558 | 2 | ↓ |