In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 24 | Yes |
Popular Name: (2R)-2-[4-[2-(diethylamino)-2-oxo-ethyl]piperazin-1-yl]-N-isopentyl-propanamide (2R)-2-[4-[2-(diethylamino)-2-ox…
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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) | 1.43 | 6.19 | -38.54 | 2 | 6 | 1 | 57 | 341.52 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 6.13 | -36.75 | 2 | 6 | 1 | 57 | 341.52 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 3.94 | -11.22 | 1 | 6 | 0 | 56 | 340.512 | 9 | ↓ |