General Information of the Compound
| Compound ID |
CP0861094
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| Compound Name |
SID49714741
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| Structure |
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| Formula |
C26H37ClN4O2
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| Molecular Weight |
473.061
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| Canonical SMILES |
Cc1oc(-c2ccc(Cl)cc2)nc1CN1CCC(C(=O)NCCCN2CCCC(C)C2)CC1
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| InChI |
InChI=1S/C26H37ClN4O2/c1-19-5-3-13-30(17-19)14-4-12-28-25(32)21-10-15-31(16-11-21)18-24-20(2)33-26(29-24)22-6-8-23(27)9-7-22/h6-9,19,21H,3-5,10-18H2,1-2H3,(H,28,32)
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| InChIKey |
BIMKBNAHNNPTBJ-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
Protein ID: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06033, Microphthalmia-associated transcription factor