In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 10 | Yes |
Popular Name: Piperazinone, 1-(2-aminoethyl)- (9CI) Piperazinone, 1-(2-aminoethyl)- …
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CAS Number: 356069-02-8
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) | -2.24 | -1.2 | -104.34 | 5 | 4 | 2 | 65 | 145.206 | 2 | ↓ |
Hi High (pH 8-9.5) | -2.24 | -2.59 | -45.42 | 4 | 4 | 1 | 60 | 144.198 | 2 | ↓ |
Hi High (pH 8-9.5) | -2.24 | -2.97 | -8.36 | 3 | 4 | 0 | 58 | 143.19 | 2 | ↓ |