In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 26 | Yes |
Popular Name: 1-tert-butyl-4-(8-chloro-10,11-dihydrodibenzo[b,f]thiepin-10-yl)piperazine 1-tert-butyl-4-(8-chloro-10,11-d…
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) | 5.57 | 12.59 | -36.32 | 1 | 2 | 1 | 8 | 388 | 2 | ↓ |
Hi High (pH 8-9.5) | 5.57 | 10.4 | -2.98 | 0 | 2 | 0 | 6 | 386.992 | 2 | ↓ |