General Information of the Compound
| Compound ID |
CP0902821
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| Compound Name |
N-[(3S,4R)-4-hydroxy-2-oxo-pyrrolidin-3-yl]-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanamide
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| Structure |
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| Formula |
C22H23N3O4
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| Molecular Weight |
393.443
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| Canonical SMILES |
COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N[C@@H]2C(=O)NC[C@H]2O)cc1
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| InChI |
InChI=1S/C22H23N3O4/c1-29-14-8-6-13(7-9-14)20-16(15-4-2-3-5-17(15)24-20)10-11-19(27)25-21-18(26)12-23-22(21)28/h2-9,18,21,24,26H,10-12H2,1H3,(H,23,28)(H,25,27)/t18-,21+/m1/s1
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| InChIKey |
JZALZTLCXBIYQS-NQIIRXRSSA-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