General Information of the Compound
| Compound ID |
CP0444416
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| Compound Name |
(2R)-5-(diaminomethylideneamino)-2-[(5-dibenzofuran-4-ylfuran-2-carbonyl)amino]pentanoic acid
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| Structure |
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| Formula |
C23H22N4O5
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| Molecular Weight |
434.452
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| Canonical SMILES |
NC(N)=NCCC[C@@H](NC(=O)c1ccc(o1)-c1cccc2c3ccccc3oc12)C(O)=O
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| InChI |
InChI=1S/C23H22N4O5/c24-23(25)26-12-4-8-16(22(29)30)27-21(28)19-11-10-18(31-19)15-7-3-6-14-13-5-1-2-9-17(13)32-20(14)15/h1-3,5-7,9-11,16H,4,8,12H2,(H,27,28)(H,29,30)(H4,24,25,26)/t16-/m1/s1
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| InChIKey |
BBXRNOGBZXRXGU-MRXNPFEDSA-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