General Information of the Compound
| Compound ID |
CP0311204
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| Compound Name |
(4S)-3-(4-cyanopyridin-2-yl)-N-[(1S)-1-[(3,3-difluorocyclobutyl)carbamoyl]-2,3-dihydroinden-1-yl]-N-(3-fluorophenyl)-2-oxo-1,3-oxazolidine-4-carboxamide
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| Structure |
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| Formula |
C30H24F3N5O4
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| Molecular Weight |
575.547
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| Canonical SMILES |
Fc1cccc(c1)N(C(=O)[C@@H]1COC(=O)N1c1cc(ccn1)C#N)[C@]1(CCc2ccccc12)C(=O)NC1CC(F)(F)C1
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| InChI |
InChI=1S/C30H24F3N5O4/c31-20-5-3-6-22(13-20)38(26(39)24-17-42-28(41)37(24)25-12-18(16-34)9-11-35-25)30(10-8-19-4-1-2-7-23(19)30)27(40)36-21-14-29(32,33)15-21/h1-7,9,11-13,21,24H,8,10,14-15,17H2,(H,36,40)/t24-,30-/m0/s1
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| InChIKey |
LXXKKNROBAICHG-NGQVCNFZSA-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