In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 20 | Yes |
Popular Name: (2R)-2-[4-[(1R)-1-methylpropyl]piperazin-1-yl]-1-phenyl-propan-1-one (2R)-2-[4-[(1R)-1-methylpropyl]p…
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) | 2.92 | 8.19 | -34.48 | 1 | 3 | 1 | 25 | 275.416 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.92 | 6.38 | -6.54 | 0 | 3 | 0 | 24 | 274.408 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.