In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 15th, 2010 | 16 | Yes |
Popular Name: 4,7-dioxa-13-azatricyclo[8.5.0.0^{3,8}]pentadeca-1(10),2,8-trien-12-one 4,7-dioxa-13-azatricyclo[8.5.0.0…
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CAS Number: 1209081-98-0
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) | 0.70 | 2.69 | -12.12 | 1 | 4 | 0 | 48 | 219.24 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 226 - 228 | Enamine Building Blocks |
MP | 226...228 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |