In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2011 | 27 | Yes |
Popular Name: [4-[(1R)-1-(4-chlorophenyl)ethyl]piperazin-1-yl]-(2,3-dimethoxyphenyl)methanone [4-[(1R)-1-(4-chlorophenyl)ethyl…
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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) | 3.80 | 8.78 | -14.28 | 0 | 5 | 0 | 42 | 388.895 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.80 | 10.69 | -54.09 | 1 | 5 | 1 | 43 | 389.903 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.