General Information of the Compound
| Compound ID |
CP0736210
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| Compound Name |
SID124893542
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| Structure |
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| Formula |
C8H11N5O3
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| Molecular Weight |
225.208
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| Canonical SMILES |
Nc1nc(O)c2c(ncn2COCCO)n1
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| InChI |
InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)13(3-10-6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15)
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| InChIKey |
ZEJSSOYUBQMVHC-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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