General Information of the Compound
| Compound ID |
CP0473449
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| Compound Name |
N-[(1-hydroxycyclobutyl)methyl]-1-[(4-pyrazol-1-ylphenyl)methyl]pyrrolo[3,2-b]pyridine-3-carboxamide
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| Structure |
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| Formula |
C23H23N5O2
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| Molecular Weight |
401.47
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| Canonical SMILES |
OC1(CNC(=O)c2cn(Cc3ccc(cc3)-n3cccn3)c3cccnc23)CCC1
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| InChI |
InChI=1S/C23H23N5O2/c29-22(25-16-23(30)9-2-10-23)19-15-27(20-4-1-11-24-21(19)20)14-17-5-7-18(8-6-17)28-13-3-12-26-28/h1,3-8,11-13,15,30H,2,9-10,14,16H2,(H,25,29)
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| InChIKey |
UBLVCMJAWALPPL-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