General Information of the Compound
| Compound ID |
CP0409234
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| Compound Name |
methyl 4-[[6-[[(2-propan-2-ylpyrazolo[1,5-a]pyridine-7-carbonyl)amino]methyl]-3-azabicyclo[3.1.0]hexan-3-yl]methyl]piperidine-1-carboxylate
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| Structure |
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| Formula |
C25H35N5O3
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| Molecular Weight |
453.587
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| Canonical SMILES |
COC(=O)N1CCC(CN2CC3C(CNC(=O)c4cccc5cc(nn45)C(C)C)C3C2)CC1
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| InChI |
InChI=1S/C25H35N5O3/c1-16(2)22-11-18-5-4-6-23(30(18)27-22)24(31)26-12-19-20-14-28(15-21(19)20)13-17-7-9-29(10-8-17)25(32)33-3/h4-6,11,16-17,19-21H,7-10,12-15H2,1-3H3,(H,26,31)
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| InChIKey |
RRAFXSKULXOHMF-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