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Chemical ID: 4431002
Chemical Details
Atom Count
Formula: | C22H16N2OS3 |
All Atoms: | 28 |
Heavy Atoms: | 28 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 12.7083 |
Area: | 611.879 |
Solvation: | -2.58863 |
Coulombic: | -21.0052 |
Bond Count [?]
All: | 31 |
Single: | 19 |
Double: | 12 |
Rotors: | 6 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 420.573 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 1 |
XLogP: | 5.35 |
LogP (Chemaxon): | 6.86 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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