General Information of the Compound
| Compound ID |
CP0438841
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| Compound Name |
6-Benzyloxy-1-[2-(4-methyl-[1,4]diazepan-1-yl)-ethyl]-1H-indole
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| Structure |
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| Formula |
C23H29N3O
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| Molecular Weight |
363.505
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| Canonical SMILES |
CN1CCCN(CCn2ccc3ccc(OCc4ccccc4)cc23)CC1
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| InChI |
InChI=1S/C23H29N3O/c1-24-11-5-12-25(15-14-24)16-17-26-13-10-21-8-9-22(18-23(21)26)27-19-20-6-3-2-4-7-20/h2-4,6-10,13,18H,5,11-12,14-17,19H2,1H3
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| InChIKey |
MSGXQUPROSRISX-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