In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2008 | 15 | Yes |
Popular Name: 1-tert-Butoxy-3-piperazin-1-yl-propan-2-ol 1-tert-Butoxy-3-piperazin-1-yl-p…
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CAS Number: 842955-16-2
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 | -0.47 | -39.4 | 3 | 4 | 1 | 49 | 217.333 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.16 | -1.82 | -4.84 | 2 | 4 | 0 | 45 | 216.325 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |