| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 30 | Yes |
Popular Name: 6,8-dimethyl-N-[3-(4-methylpiperazin-1-yl)propyl]benzo[b][1,5]benzothiazepine-3-carboxamide 6,8-dimethyl-N-[3-(4-methylpiper…
| 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) | 4.13 | 9.55 | -47.15 | 2 | 5 | 1 | 50 | 423.606 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.13 | 7.18 | -14.22 | 1 | 5 | 0 | 48 | 422.598 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.13 | 9.44 | -50.59 | 2 | 5 | 1 | 50 | 423.606 | 5 | ↓ |
