In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 29 | Yes |
Popular Name: 2-[4-[2-[(4-fluorophenyl)amino]-2-oxo-ethyl]piperazin-1-yl]-N-(4-methoxyphenyl)acetamide 2-[4-[2-[(4-fluorophenyl)amino]-…
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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) | 2.80 | 5.9 | -50.96 | 3 | 7 | 1 | 75 | 401.462 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 5.92 | -51.9 | 3 | 7 | 1 | 75 | 401.462 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.80 | 3.67 | -18.38 | 2 | 7 | 0 | 74 | 400.454 | 7 | ↓ |