In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2010 | 24 | Yes |
Popular Name: 2-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]-N,N-diisobutyl-acetamide 2-[4-[2-(dimethylamino)acetyl]pi…
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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) | 1.18 | 7.59 | -43.68 | 1 | 6 | 1 | 48 | 341.52 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.18 | 5.17 | -13.38 | 0 | 6 | 0 | 47 | 340.512 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.18 | 9.67 | -101.43 | 2 | 6 | 2 | 49 | 342.528 | 8 | ↓ |