General Information of the Compound
| Compound ID |
CP0513692
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| Compound Name |
N-[3-[benzyl(propan-2-yl)amino]propyl]-4-methylthieno[3,2-b]pyrrole-5-carboxamide
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| Structure |
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| Formula |
C21H27N3OS
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| Molecular Weight |
369.534
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| Canonical SMILES |
CC(C)N(CCCNC(=O)c1cc2sccc2n1C)Cc1ccccc1
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| InChI |
InChI=1S/C21H27N3OS/c1-16(2)24(15-17-8-5-4-6-9-17)12-7-11-22-21(25)19-14-20-18(23(19)3)10-13-26-20/h4-6,8-10,13-14,16H,7,11-12,15H2,1-3H3,(H,22,25)
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| InChIKey |
HSUWWBYTINLYDY-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