In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 18 | Yes |
Popular Name: 1-[2-(adamantan-1-yl)ethyl]piperazine dihydrochloride 1-[2-(adamantan-1-yl)ethyl]piper…
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CAS Number: 1311316-88-7
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) | 2.85 | 6.12 | -36.97 | 2 | 2 | 1 | 20 | 249.422 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.85 | 7.03 | -35.77 | 2 | 2 | 1 | 16 | 249.422 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.85 | 8.38 | -119.19 | 3 | 2 | 2 | 21 | 250.43 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |