In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2013 | 12 | Yes |
Popular Name: 1-methyl-4-(2-methylbut-3-yn-2-yl)piperazine 1-methyl-4-(2-methylbut-3-yn-2-y…
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CAS Number: 169194-80-3
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) | 1.20 | 4.25 | -32.4 | 1 | 2 | 1 | 8 | 167.276 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 1.88 | -2.6 | 0 | 2 | 0 | 6 | 166.268 | 1 | ↓ |
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