General Information of the Compound
| Compound ID |
CP0280987
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| Compound Name |
N-(3,4-dihydro-2H-chromen-2-ylmethyl)-N'-(1,4,5,6-tetrahydropyrimidin-2-yl)pentane-1,5-diamine
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| Structure |
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| Formula |
C19H30N4O
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| Molecular Weight |
330.476
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| Canonical SMILES |
C(CCNCC1CCc2ccccc2O1)CCNC1=NCCCN1
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| InChI |
InChI=1S/C19H30N4O/c1(5-12-21-19-22-13-6-14-23-19)4-11-20-15-17-10-9-16-7-2-3-8-18(16)24-17/h2-3,7-8,17,20H,1,4-6,9-15H2,(H2,21,22,23)
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| InChIKey |
FGWYYRTVGNYTGY-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