| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 25 | Yes |
Popular Name: 3-[(2R,6R)-2,6-dimethyl-4-(p-tolylmethylsulfonyl)piperazin-1-yl]-N,N-dimethyl-propan-1-amine 3-[(2R,6R)-2,6-dimethyl-4-(p-tol…
| 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) | 2.61 | 7.23 | -45.27 | 1 | 5 | 1 | 45 | 368.567 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.61 | 9.29 | -115.67 | 2 | 5 | 2 | 46 | 369.575 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.61 | 6.81 | -47.22 | 1 | 5 | 1 | 45 | 368.567 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
