In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 4th, 2010 | 22 | Yes |
Popular Name: (2S)-1-(4-acetylpiperazin-1-yl)-2-(4-isopropylpiperazin-1-yl)propan-1-one (2S)-1-(4-acetylpiperazin-1-yl)-…
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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) | -0.16 | 5.08 | -40.59 | 1 | 6 | 1 | 48 | 311.45 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.16 | 2.78 | -11.8 | 0 | 6 | 0 | 47 | 310.442 | 3 | ↓ |