In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2011 | 16 | Yes |
Popular Name: (3R)-1-[2-(4-chlorophenyl)ethyl]-3-methyl-piperazine (3R)-1-[2-(4-chlorophenyl)ethyl]…
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) | 2.80 | 5.66 | -38.13 | 2 | 2 | 1 | 20 | 239.77 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 4.37 | -2.61 | 1 | 2 | 0 | 15 | 238.762 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.