In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2011 | 21 | Yes |
Popular Name: 2-[isopropyl(methyl)amino]-1-[4-(morpholinomethyl)-1-piperidyl]ethanone 2-[isopropyl(methyl)amino]-1-[4-…
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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) | 1.01 | 5.76 | -36.85 | 1 | 5 | 1 | 37 | 298.451 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 3.54 | -8.75 | 0 | 5 | 0 | 36 | 297.443 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 7.75 | -86.19 | 2 | 5 | 2 | 38 | 299.459 | 5 | ↓ |