General Information of the Compound
| Compound ID |
CP0438878
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| Compound Name |
N-[2-[2-(diaminomethylideneamino)ethyl]-1-(2-naphthalen-2-ylethyl)indol-5-yl]-3-(4-hydroxyphenyl)propanamide
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| Structure |
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| Formula |
C32H33N5O2
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| Molecular Weight |
519.649
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| Canonical SMILES |
NC(N)=NCCc1cc2cc(NC(=O)CCc3ccc(O)cc3)ccc2n1CCc1ccc2ccccc2c1
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| InChI |
InChI=1S/C32H33N5O2/c33-32(34)35-17-15-28-21-26-20-27(36-31(39)14-8-22-6-11-29(38)12-7-22)10-13-30(26)37(28)18-16-23-5-9-24-3-1-2-4-25(24)19-23/h1-7,9-13,19-21,38H,8,14-18H2,(H,36,39)(H4,33,34,35)
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| InChIKey |
WMEJDQOPUSKSFH-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