| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 25th, 2009 | 23 | Yes |
Popular Name: 1-(2-dimethylaminoethylamino)-4-(hydroxymethyl)thioxanthen-9-one 1-(2-dimethylaminoethylamino)-4-…
None
| 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) | 3.53 | 6.19 | -94.87 | 4 | 4 | 2 | 59 | 330.453 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 3.98 | -9.98 | 2 | 4 | 0 | 53 | 328.437 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.53 | 3.67 | -33.84 | 3 | 4 | 1 | 58 | 329.445 | 4 | ↓ |
