General Information of the Compound
| Compound ID |
CP0075568
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| Compound Name |
(S)-2-amino-N-(2-(benzyloxy)-1-(1-(5-(methylsulfonamido)pentyl)-1H-tetrazol-5-yl)ethyl)-2-methylpropanamide
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| Structure |
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| Formula |
C20H33N7O4S
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| Molecular Weight |
467.596
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| Canonical SMILES |
CC(C)(N)C(=O)N[C@H](COCc1ccccc1)c1nnnn1CCCCCNS(C)(=O)=O
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| InChI |
InChI=1S/C20H33N7O4S/c1-20(2,21)19(28)23-17(15-31-14-16-10-6-4-7-11-16)18-24-25-26-27(18)13-9-5-8-12-22-32(3,29)30/h4,6-7,10-11,17,22H,5,8-9,12-15,21H2,1-3H3,(H,23,28)/t17-/m1/s1
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| InChIKey |
QYOFYAKDSWQGDP-QGZVFWFLSA-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