General Information of the Compound
| Compound ID |
CP0230166
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| Compound Name |
(4S)-N-[(1S)-7-chloro-1-[(3,3-difluorocyclobutyl)carbamoyl]-2,3-dihydroinden-1-yl]-3-(4-cyanopyridin-2-yl)-N-(3-fluorophenyl)-2-oxo-1,3-oxazolidine-4-carboxamide
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| Structure |
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| Formula |
C30H23ClF3N5O4
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| Molecular Weight |
609.992
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| Canonical SMILES |
Fc1cccc(c1)N(C(=O)[C@@H]1COC(=O)N1c1cc(ccn1)C#N)[C@]1(CCc2cccc(Cl)c12)C(=O)NC1CC(F)(F)C1
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| InChI |
InChI=1S/C30H23ClF3N5O4/c31-22-6-1-3-18-7-9-30(25(18)22,27(41)37-20-13-29(33,34)14-20)39(21-5-2-4-19(32)12-21)26(40)23-16-43-28(42)38(23)24-11-17(15-35)8-10-36-24/h1-6,8,10-12,20,23H,7,9,13-14,16H2,(H,37,41)/t23-,30-/m0/s1
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| InChIKey |
RQQBSKLEQRCHFA-JHOBJCJYSA-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