General Information of the Compound
| Compound ID |
CP0955621
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| Compound Name |
(S)-2-(4-(1-acryloyl-1,2,5,6-tetrahydropyridin-3-yl)phenyl)-N-(5-cyclopropyl-1H-pyrazol-3-yl)propanamide
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| Structure |
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| Formula |
C23H26N4O2
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| Molecular Weight |
390.487
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| Canonical SMILES |
C=CC(=O)N1CCC=C(c2ccc([C@H](C)C(=O)Nc3cc(C4CC4)[nH]n3)cc2)C1
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| InChI |
InChI=1S/C23H26N4O2/c1-3-22(28)27-12-4-5-19(14-27)17-8-6-16(7-9-17)15(2)23(29)24-21-13-20(25-26-21)18-10-11-18/h3,5-9,13,15,18H,1,4,10-12,14H2,2H3,(H2,24,25,26,29)/t15-/m0/s1
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| InChIKey |
GOOZCRGJKQVEFX-HNNXBMFYSA-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