General Information of the Compound
| Compound ID |
CP0903295
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| Compound Name |
Isopropyl (R)-4-(1-(3-(((4-Methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)carbamoyl)-2-methyl-1H-indol-1-yl)ethyl)-piperidine-1-carboxylate
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| Formula |
C29H38N4O5
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| Molecular Weight |
522.646
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| Canonical SMILES |
COc1cc(C)[nH]c(=O)c1CNC(=O)c1c(C)n([C@H](C)C2CCN(C(=O)OC(C)C)CC2)c2ccccc12
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| InChI |
InChI=1S/C29H38N4O5/c1-17(2)38-29(36)32-13-11-21(12-14-32)19(4)33-20(5)26(22-9-7-8-10-24(22)33)28(35)30-16-23-25(37-6)15-18(3)31-27(23)34/h7-10,15,17,19,21H,11-14,16H2,1-6H3,(H,30,35)(H,31,34)/t19-/m1/s1
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| InChIKey |
ARVPXNDKJJUDGF-LJQANCHMSA-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