General Information of the Compound
| Compound ID |
CP0387541
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| Compound Name |
5-(2-Guanidino-acetylamino)-1-(3-guanidino-propyl)-1H-indole-2-carboxylic acid [2-(1H-indol-3-yl)-ethyl]-amide
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| Structure |
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| Formula |
C26H32N10O2
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| Molecular Weight |
516.61
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| Canonical SMILES |
NC(N)=NCCCn1c(cc2cc(NC(=O)CN=C(N)N)ccc12)C(=O)NCCc1c[nH]c2ccccc12
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| InChI |
InChI=1S/C26H32N10O2/c27-25(28)32-9-3-11-36-21-7-6-18(35-23(37)15-34-26(29)30)12-17(21)13-22(36)24(38)31-10-8-16-14-33-20-5-2-1-4-19(16)20/h1-2,4-7,12-14,33H,3,8-11,15H2,(H,31,38)(H,35,37)(H4,27,28,32)(H4,29,30,34)
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| InChIKey |
ZXBHUQJCXZWNQY-UHFFFAOYSA-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