In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 24th, 2009 | 14 | Yes |
Popular Name: Piperazine, 1-(3,6-dimethyl-2-pyridinyl)- (9CI) Piperazine, 1-(3,6-dimethyl-2-py…
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CAS Number: 163613-81-8
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) | 0.89 | 5.84 | -86.68 | 3 | 3 | 2 | 34 | 193.294 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.89 | 4.53 | -24.02 | 2 | 3 | 1 | 29 | 192.286 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.89 | 5.4 | -39.73 | 2 | 3 | 1 | 33 | 192.286 | 1 | ↓ |