In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2010 | 14 | Yes |
Popular Name: 3-methyl-1-(6-methylpyridin-2-yl)piperazine 3-methyl-1-(6-methylpyridin-2-yl…
Find On: PubMed — Wikipedia — Google
CAS Number: 1247658-97-4
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) | 1.17 | 5.56 | -87.49 | 3 | 3 | 2 | 34 | 193.294 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.17 | 4.01 | -5.05 | 1 | 3 | 0 | 28 | 191.278 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.17 | 4.32 | -24.38 | 2 | 3 | 1 | 29 | 192.286 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.17 | 5.26 | -39.42 | 2 | 3 | 1 | 33 | 192.286 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |