General Information of the Compound
| Compound ID |
CP0400620
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| Compound Name |
US8975247, EBP467
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| Structure |
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| Formula |
C22H26ClN3
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| Molecular Weight |
367.924
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| Canonical SMILES |
Cc1cc2nc(CC3CCNCC3)n(Cc3ccc(Cl)cc3)c2cc1C
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| InChI |
InChI=1S/C22H26ClN3/c1-15-11-20-21(12-16(15)2)26(14-18-3-5-19(23)6-4-18)22(25-20)13-17-7-9-24-10-8-17/h3-6,11-12,17,24H,7-10,13-14H2,1-2H3
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| InChIKey |
IELYGTRDWPOQLE-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