In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 31 | Yes |
Popular Name: 1-(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)-4-(3-phenylpropyl)piperazine 1-(8-chloro-10,11-dihydrodibenzo…
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) | 6.70 | 16.43 | -44.47 | 1 | 2 | 1 | 8 | 450.071 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.70 | 15.66 | -38.42 | 1 | 2 | 1 | 8 | 450.071 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.70 | 14.12 | -4.57 | 0 | 2 | 0 | 6 | 449.063 | 5 | ↓ |