| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 2nd, 2008 | 19 | Yes |
Popular Name: 2-[(4-methylpiperazin-1-yl)carbonyl]-3,4-dihydro-2H-1,4-benzoxazine 2-[(4-methylpiperazin-1-yl)carbo…
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CAS Number: 1016851-60-7
| 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) | 0.90 | 3.12 | -13.76 | 1 | 5 | 0 | 45 | 261.325 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.90 | 5.51 | -54.48 | 2 | 5 | 1 | 46 | 262.333 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 132 - 134 | Enamine Building Blocks |
| MP | 132...134 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
