In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 15 | Yes |
Popular Name: 6-(2-methylpropanoyl)-2,3-dihydro-1,3-benzoxazol-2-one 6-(2-methylpropanoyl)-2,3-dihydr…
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CAS Number: 70735-86-3
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) | 2.25 | 1.23 | -47.53 | 0 | 4 | -1 | 66 | 204.205 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.80 | 3.85 | -13.73 | 1 | 4 | 0 | 63 | 205.213 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 188 - 190 | Enamine Building Blocks |
MP | 188...190 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |