In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 26th, 2011 | 28 | Yes |
Popular Name: (2R)-2-[4-[2-[benzyl(methyl)amino]ethyl]piperazin-1-yl]-2-(4-fluorophenyl)acetamide (2R)-2-[4-[2-[benzyl(methyl)amin…
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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) | 2.14 | 6.21 | -44.21 | 3 | 5 | 1 | 54 | 385.507 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.14 | 3.88 | -9.62 | 2 | 5 | 0 | 53 | 384.499 | 8 | ↓ |