General Information of the Compound
| Compound ID |
CP0256577
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| Compound Name |
CHEMBL2180631
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| Formula |
C24H29N3O3
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| Molecular Weight |
407.514
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| Canonical SMILES |
OC(=O)c1cccn1Cc1ccccc1CNC(=O)NC12C[C@H]3C[C@H](C[C@H](C3)C1)C2
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| InChI |
InChI=1S/C24H29N3O3/c28-22(29)21-6-3-7-27(21)15-20-5-2-1-4-19(20)14-25-23(30)26-24-11-16-8-17(12-24)10-18(9-16)13-24/h1-7,16-18H,8-15H2,(H,28,29)(H2,25,26,30)/t16-,17+,18-,24?
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| InChIKey |
CTHKDKLREUOIGQ-AHSSAWHLSA-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