In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 12th, 2008 | 17 | Yes |
Popular Name: 1-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]ethan-1-amine 1-[3-fluoro-4-(4-methylpiperazin…
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CAS Number: 1019552-56-7
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) | -0.11 | 4.7 | -95.67 | 4 | 3 | 2 | 35 | 239.338 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.11 | 2.23 | -51.41 | 3 | 3 | 1 | 34 | 238.33 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |