In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 25 | Yes |
Popular Name: 1-[2-[methyl(2-thienylmethyl)amino]-2-oxo-ethyl]-N-pentyl-piperidine-4-carboxamide 1-[2-[methyl(2-thienylmethyl)ami…
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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) | 2.81 | 9.45 | -50.74 | 2 | 5 | 1 | 54 | 366.551 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 7.25 | -17.91 | 1 | 5 | 0 | 53 | 365.543 | 9 | ↓ |