| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 14th, 2009 | 27 | Yes |
Popular Name: 1-(2-diethylaminoethyl-methyl-amino)-4-(methylaminomethyl)thioxanthen-9-one 1-(2-diethylaminoethyl-methyl-am…
| 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) | 0.53 | 11.17 | -158.05 | 4 | 4 | 3 | 44 | 386.585 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.56 | 9.66 | -50.7 | 2 | 4 | 1 | 40 | 384.569 | 8 | ↓ |
| Mid Mid (pH 6-8) | 4.56 | 11.98 | -88.4 | 3 | 4 | 2 | 41 | 385.577 | 8 | ↓ |
