General Information of the Compound
| Compound ID |
CP0546058
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| Compound Name |
1-[(E)-(5-chloro-1H-indol-3-yl)methylideneamino]-2-[2-(4-chlorophenyl)ethyl]guanidine
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| Structure |
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| Formula |
C18H17Cl2N5
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| Molecular Weight |
374.275
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| Canonical SMILES |
Clc1ccc(CCNC(=N)N\N=C\c2c[nH]c3ccc(Cl)cc23)cc1
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| InChI |
InChI=1S/C18H17Cl2N5/c19-14-3-1-12(2-4-14)7-8-22-18(21)25-24-11-13-10-23-17-6-5-15(20)9-16(13)17/h1-6,9-11,23H,7-8H2,(H3,21,22,25)/b24-11+
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| InChIKey |
FYFUCVQCMZCVMF-BHGWPJFGSA-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