| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 9th, 2007 | 15 | Yes |
Popular Name: 4-(2-hydroxyethylaminomethyl)-9-thia-3,5-diazabicyclo[4.3.0]nona-4,7,10-trien-2-one 4-(2-hydroxyethylaminomethyl)-9-…
| 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) | -0.22 | -0.3 | -52.63 | 4 | 5 | 1 | 83 | 226.281 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.22 | -2.27 | -24.48 | 3 | 5 | 0 | 78 | 225.273 | 4 | ↓ |
