General Information of the Compound
| Compound ID |
CP0455535
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| Compound Name |
(5R)-6-acetyl-N-[1-[(2-ethoxyphenyl)methyl]-2,3-dihydroindol-5-yl]-2-methoxy-7,8-dihydro-5H-1,6-naphthyridine-5-carboxamide
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| Structure |
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| Formula |
C29H32N4O4
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| Molecular Weight |
500.599
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| Canonical SMILES |
CCOc1ccccc1CN1CCc2cc(NC(=O)[C@@H]3N(CCc4nc(OC)ccc34)C(C)=O)ccc12
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| InChI |
InChI=1S/C29H32N4O4/c1-4-37-26-8-6-5-7-21(26)18-32-15-13-20-17-22(9-11-25(20)32)30-29(35)28-23-10-12-27(36-3)31-24(23)14-16-33(28)19(2)34/h5-12,17,28H,4,13-16,18H2,1-3H3,(H,30,35)/t28-/m1/s1
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| InChIKey |
UEJQTTNTWAHTCC-MUUNZHRXSA-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