General Information of the Compound
| Compound ID |
CP0538422
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| Compound Name |
2,3-dihydro-1H-inden-5-ylmethyl N-[(3S)-2-oxoazetidin-3-yl]carbamate
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| Structure |
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| Formula |
C14H16N2O3
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| Molecular Weight |
260.293
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| Canonical SMILES |
O=C(N[C@H]1CNC1=O)OCc1ccc2CCCc2c1
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| InChI |
InChI=1S/C14H16N2O3/c17-13-12(7-15-13)16-14(18)19-8-9-4-5-10-2-1-3-11(10)6-9/h4-6,12H,1-3,7-8H2,(H,15,17)(H,16,18)/t12-/m0/s1
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| InChIKey |
WEAVXTAWMQIIJU-LBPRGKRZSA-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