In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 15 | Yes |
Popular Name: 3-diethylamino-1-piperazin-1-yl-propan-1-one 3-diethylamino-1-piperazin-1-yl-…
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CAS Number: N/A
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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) | 0.01 | 3.22 | -40.47 | 2 | 4 | 1 | 37 | 214.333 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.01 | 1.25 | -6.77 | 1 | 4 | 0 | 36 | 213.325 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.01 | 4.61 | -98.75 | 3 | 4 | 2 | 41 | 215.341 | 5 | ↓ |