General Information of the Compound
| Compound ID |
CP0894625
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| Compound Name |
2,3-Dipentoxyterephthaldehyde-1,4-bis-guanylhydrazone dihydro dichloride
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| Structure |
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| Formula |
C20H36Cl2N8O2
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| Molecular Weight |
491.468
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| Canonical SMILES |
CCCCCOc1c(/C=N/N=C(N)N)ccc(/C=N/N=C(N)N)c1OCCCCC.Cl.Cl
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| InChI |
InChI=1S/C20H34N8O2.2ClH/c1-3-5-7-11-29-17-15(13-25-27-19(21)22)9-10-16(14-26-28-20(23)24)18(17)30-12-8-6-4-2;;/h9-10,13-14H,3-8,11-12H2,1-2H3,(H4,21,22,27)(H4,23,24,28);2*1H/b25-13+,26-14+;;
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| InChIKey |
YUISEVCRPRXISN-AREIFDNXSA-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