General Information of the Compound
| Compound ID |
CP0430483
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| Compound Name |
2-methylpropyl N-[(2S)-3-(1H-indol-3-yl)-1-(3-methylbutylamino)-1-oxopropan-2-yl]carbamate
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| Structure |
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| Formula |
C21H31N3O3
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| Molecular Weight |
373.497
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| Canonical SMILES |
CC(C)CCNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OCC(C)C
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| InChI |
InChI=1S/C21H31N3O3/c1-14(2)9-10-22-20(25)19(24-21(26)27-13-15(3)4)11-16-12-23-18-8-6-5-7-17(16)18/h5-8,12,14-15,19,23H,9-11,13H2,1-4H3,(H,22,25)(H,24,26)/t19-/m0/s1
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| InChIKey |
KJIOXMDZHQAFNH-IBGZPJMESA-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