General Information of the Compound
| Compound ID |
CP0261623
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| Compound Name |
N-[2-[(2S)-2-cyanopyrrolidin-1-yl]-2-oxoethyl]-3-phenylbenzamide
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| Structure |
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| Formula |
C20H19N3O2
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| Molecular Weight |
333.391
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| Canonical SMILES |
O=C(CNC(=O)c1cccc(c1)-c1ccccc1)N1CCC[C@H]1C#N
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| InChI |
InChI=1S/C20H19N3O2/c21-13-18-10-5-11-23(18)19(24)14-22-20(25)17-9-4-8-16(12-17)15-6-2-1-3-7-15/h1-4,6-9,12,18H,5,10-11,14H2,(H,22,25)/t18-/m0/s1
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| InChIKey |
FJWRWAFBWCAAQZ-SFHVURJKSA-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