General Information of the Compound
| Compound ID |
CP0847870
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| Compound Name |
2,3-Dibutoxyterephthaldehyde-1,4-bis-guanylhydrazone dihydro dichloride
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| Structure |
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| Formula |
C18H32Cl2N8O2
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| Molecular Weight |
463.414
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| Canonical SMILES |
CCCCOc1c(/C=N/N=C(N)N)ccc(/C=N/NC(=N)N)c1OCCCC.Cl.Cl
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| InChI |
InChI=1S/C18H30N8O2.2ClH/c1-3-5-9-27-15-13(11-23-25-17(19)20)7-8-14(12-24-26-18(21)22)16(15)28-10-6-4-2;;/h7-8,11-12H,3-6,9-10H2,1-2H3,(H4,19,20,25)(H4,21,22,26);2*1H/b23-11+,24-12+;;
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| InChIKey |
ZCOUUQDHYSUWEK-JKCMIZSDSA-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