General Information of the Compound
| Compound ID |
CP0941202
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| Compound Name |
SID57268543
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| Structure |
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| Formula |
C26H31N3O5S
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| Molecular Weight |
497.617
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| Canonical SMILES |
Cc1cc(C)c(S(=O)(=O)N2CCN(C(=O)c3ccccc3OCc3c(C)noc3C)CC2)c(C)c1
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| InChI |
InChI=1S/C26H31N3O5S/c1-17-14-18(2)25(19(3)15-17)35(31,32)29-12-10-28(11-13-29)26(30)22-8-6-7-9-24(22)33-16-23-20(4)27-34-21(23)5/h6-9,14-15H,10-13,16H2,1-5H3
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| InChIKey |
LJLXYBNCBJQZTN-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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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