General Information of the Compound
| Compound ID |
CP0709611
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| Compound Name |
N-methyl-N'-(1-methyl-3,5,11b-triaza-cyclopenta[a]anthracen-4-yl)-ethane-1,2-diamine hydrochloride
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| Structure |
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| Formula |
C18H20ClN5
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| Molecular Weight |
341.846
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| Canonical SMILES |
CNCCNc1nc2cc3ccccc3cc2n2c(C)cnc12.Cl
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| InChI |
InChI=1S/C18H19N5.ClH/c1-12-11-21-18-17(20-8-7-19-2)22-15-9-13-5-3-4-6-14(13)10-16(15)23(12)18;/h3-6,9-11,19H,7-8H2,1-2H3,(H,20,22);1H
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| InChIKey |
QUJPNNBYBPMUCK-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