In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 18 | Yes |
Popular Name: 1-[(2R,6R)-2,6-dimethylpiperazin-1-yl]-2-phenylsulfanyl-ethanone 1-[(2R,6R)-2,6-dimethylpiperazin…
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) | 1.68 | 6.92 | -52.14 | 2 | 3 | 1 | 37 | 265.402 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.68 | 5.56 | -8.72 | 1 | 3 | 0 | 32 | 264.394 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.