| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 6th, 2009 | 25 | Yes |
Popular Name: 1-(2-diethylaminoethylamino)-7-hydroxy-4-methyl-thioxanthen-9-one 1-(2-diethylaminoethylamino)-7-h…
| 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) | 4.89 | 7.55 | -91.25 | 4 | 4 | 2 | 59 | 358.507 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.70 | 5.56 | -12.93 | 2 | 4 | 0 | 53 | 356.491 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.89 | 5.23 | -30.71 | 3 | 4 | 1 | 58 | 357.499 | 5 | ↓ |
