General Information of the Compound
| Compound ID |
CP0574125
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| Compound Name |
US10047103, 107
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| Structure |
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| Formula |
C24H25N5O5S2
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| Molecular Weight |
527.628
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| Canonical SMILES |
COC[C@@H]1CCCN1c1nc(COc2cc(OC)cc3oc(cc23)-c2cn3nc(OC)sc3n2)cs1
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| InChI |
InChI=1S/C24H25N5O5S2/c1-30-12-15-5-4-6-28(15)22-25-14(13-35-22)11-33-19-7-16(31-2)8-20-17(19)9-21(34-20)18-10-29-23(26-18)36-24(27-29)32-3/h7-10,13,15H,4-6,11-12H2,1-3H3/t15-/m0/s1
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| InChIKey |
MYWNNHYCGXLFNE-HNNXBMFYSA-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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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound