| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 25 | Yes |
Popular Name: 6-[(3S,5R)-4-(2-methoxyethyl)-3,5-dimethyl-piperazin-1-yl]sulfonyl-3H-1,3-benzoxazol-2-one 6-[(3S,5R)-4-(2-methoxyethyl)-3,…
| 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) | 1.00 | 0.57 | -12.36 | 1 | 8 | 0 | 96 | 369.443 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | -2.06 | -45.91 | 0 | 8 | -1 | 99 | 368.435 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.00 | 2.66 | -46.71 | 2 | 8 | 1 | 97 | 370.451 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
