General Information of the Compound
| Compound ID |
CP0222631
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| Compound Name |
(S)-methyl 3-(5-(1-(2-amino-2-methylpropanamido)-2-(benzyloxy)ethyl)-1H-tetrazol-1-yl)propanoate
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| Structure |
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| Formula |
C18H26N6O4
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| Molecular Weight |
390.444
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| Canonical SMILES |
COC(=O)CCn1nnnc1[C@@H](COCc1ccccc1)NC(=O)C(C)(C)N
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| InChI |
InChI=1S/C18H26N6O4/c1-18(2,19)17(26)20-14(12-28-11-13-7-5-4-6-8-13)16-21-22-23-24(16)10-9-15(25)27-3/h4-8,14H,9-12,19H2,1-3H3,(H,20,26)/t14-/m1/s1
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| InChIKey |
YBYJNUPHQJASFD-CQSZACIVSA-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