General Information of the Compound
| Compound ID |
CP0410141
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| Compound Name |
2-imino-N-[3-[4-[3-[(2-imino-8-methoxychromene-3-carbonyl)amino]propoxy]butoxy]propyl]-8-methoxychromene-3-carboxamide
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| Structure |
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| Formula |
C32H38N4O8
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| Molecular Weight |
606.676
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| Canonical SMILES |
COc1cccc2cc(C(=O)NCCCOCCCCOCCCNC(=O)c3cc4cccc(OC)c4oc3=N)c(=N)oc12
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| InChI |
InChI=1S/C32H38N4O8/c1-39-25-11-5-9-21-19-23(29(33)43-27(21)25)31(37)35-13-7-17-41-15-3-4-16-42-18-8-14-36-32(38)24-20-22-10-6-12-26(40-2)28(22)44-30(24)34/h5-6,9-12,19-20,33-34H,3-4,7-8,13-18H2,1-2H3,(H,35,37)(H,36,38)
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| InChIKey |
JNCOYVVDNPCLKB-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