General Information of the Compound
| Compound ID |
CP0905291
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| Compound Name |
(S)-valylglycyl-(S)-alanyl-(S)-phenylalanylglycine
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| Structure |
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| Formula |
C21H31N5O6
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| Molecular Weight |
449.508
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| Canonical SMILES |
CC(C)[C@H](N)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)O
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| InChI |
InChI=1S/C21H31N5O6/c1-12(2)18(22)21(32)23-10-16(27)25-13(3)19(30)26-15(20(31)24-11-17(28)29)9-14-7-5-4-6-8-14/h4-8,12-13,15,18H,9-11,22H2,1-3H3,(H,23,32)(H,24,31)(H,25,27)(H,26,30)(H,28,29)/t13-,15-,18-/m0/s1
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| InChIKey |
ZJFRJSUJGGIMSD-YEWWUXTCSA-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