In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 16 | Yes |
Popular Name: [3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]methanol [3-fluoro-4-(4-methylpiperazin-1…
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CAS Number: 1152513-19-3
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) | 1.36 | 4.56 | -38.17 | 2 | 3 | 1 | 28 | 225.287 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.36 | 2.21 | -5.76 | 1 | 3 | 0 | 27 | 224.279 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 87 - 89 | Enamine Building Blocks |
MP | 87...89 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |