In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 15 | Yes |
Popular Name: 3-[(piperazin-1-yl)carbonyl]aniline 3-[(piperazin-1-yl)carbonyl]aniline
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CAS Number: 229634-09-7
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) | -0.75 | 1.86 | -49.36 | 4 | 4 | 1 | 63 | 206.269 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.75 | 0.61 | -8.95 | 3 | 4 | 0 | 58 | 205.261 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |