General Information of the Compound
| Compound ID |
CP0553600
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| Compound Name |
N-[5-[(2,3-difluorophenyl)methyl]-6,6-dimethyl-1,4-dihydropyrrolo[3,4-c]pyrazol-3-yl]-4-morpholin-4-ylbenzamide
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| Formula |
C25H27F2N5O2
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| Molecular Weight |
467.52
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| Canonical SMILES |
CC1(C)N(Cc2cccc(F)c2F)Cc2c(NC(=O)c3ccc(cc3)N3CCOCC3)n[nH]c12
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| InChI |
InChI=1S/C25H27F2N5O2/c1-25(2)22-19(15-32(25)14-17-4-3-5-20(26)21(17)27)23(30-29-22)28-24(33)16-6-8-18(9-7-16)31-10-12-34-13-11-31/h3-9H,10-15H2,1-2H3,(H2,28,29,30,33)
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| InChIKey |
CGLJKJPXQBOLMC-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: PT01390, BDNF/NT-3 growth factors receptor
Protein ID: PT00934, High affinity nerve growth factor receptor
Protein ID: PT00936, NT-3 growth factor receptor