| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 29 | Yes |
Popular Name: [2-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]-(4-isobutylpiperazin-1-yl)methanone [2-(1,3-benzoxazol-2-ylsulfanylm…
| 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) | 3.98 | 10.3 | -47.7 | 1 | 5 | 1 | 51 | 410.563 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.98 | 8.38 | -15.21 | 0 | 5 | 0 | 50 | 409.555 | 6 | ↓ |
![[2-[(1,3-benzoxazol-2-ylthio)methyl]phenyl]-piperazino-methanone](http://zinc12.docking.org/img/rings/184600.gif)
