In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 16 | Yes |
Popular Name: 4-{[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]methyl}aniline 4-{[3-(propan-2-yl)-1,2,4-oxadia…
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CAS Numbers: 1042499-98-8 , 1461707-36-7
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) | 2.11 | 3.44 | -7.71 | 2 | 4 | 0 | 65 | 217.272 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 154 - 156 | Enamine Building Blocks |
MP | 154...156 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |