General Information of the Compound
| Compound ID |
CP0488915
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| Compound Name |
N-[3-[1-[[(3S)-2-hydroxy-5-oxooxolan-3-yl]carbamoyl]cyclopropyl]-2,4-dioxo-1-propan-2-ylpyrimidin-5-yl]-4-(naphthalen-2-ylamino)benzamide
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| Structure |
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| Formula |
C32H31N5O7
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| Molecular Weight |
597.628
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| Canonical SMILES |
CC(C)n1cc(NC(=O)c2ccc(Nc3ccc4ccccc4c3)cc2)c(=O)n(c1=O)C1(CC1)C(=O)N[C@H]1CC(=O)OC1O
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| InChI |
InChI=1S/C32H31N5O7/c1-18(2)36-17-25(28(40)37(31(36)43)32(13-14-32)30(42)35-24-16-26(38)44-29(24)41)34-27(39)20-8-10-22(11-9-20)33-23-12-7-19-5-3-4-6-21(19)15-23/h3-12,15,17-18,24,29,33,41H,13-14,16H2,1-2H3,(H,34,39)(H,35,42)/t24-,29?/m0/s1
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| InChIKey |
JUEKXSNZEIXBRT-CTLOQAHHSA-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