| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 21st, 2009 | 34 | Yes |
Popular Name: 4-[[4-[2-(1,3-benzoxazol-2-ylsulfanylmethyl)benzoyl]piperazin-1-yl]methyl]benzonitrile 4-[[4-[2-(1,3-benzoxazol-2-ylsul…
| 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) | 4.01 | 9.86 | -18.25 | 0 | 6 | 0 | 73 | 468.582 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.01 | 12.14 | -61.56 | 1 | 6 | 1 | 75 | 469.59 | 6 | ↓ |
