In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2010 | 20 | Yes |
Popular Name: 3-(4-chloro-3-ethyl-phenoxy)-1-piperazin-1-yl-propan-1-one 3-(4-chloro-3-ethyl-phenoxy)-1-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) | 2.43 | 6.47 | -49.91 | 2 | 4 | 1 | 46 | 297.806 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 5.18 | -7.47 | 1 | 4 | 0 | 42 | 296.798 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.