General Information of the Compound
| Compound ID |
CP0898039
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| Compound Name |
SID49716976
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| Structure |
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| Formula |
C24H23ClN6O2S
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| Molecular Weight |
495.008
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| Canonical SMILES |
COc1ccc(NC(=O)c2sc3ncnc(N4CCN(c5ccccn5)CC4)c3c2C)cc1Cl
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| InChI |
InChI=1S/C24H23ClN6O2S/c1-15-20-22(31-11-9-30(10-12-31)19-5-3-4-8-26-19)27-14-28-24(20)34-21(15)23(32)29-16-6-7-18(33-2)17(25)13-16/h3-8,13-14H,9-12H2,1-2H3,(H,29,32)
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| InChIKey |
AUXWHDQNKCKZSR-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: PT06101, Latent membrane protein 1