General Information of the Compound
| Compound ID |
CP0916976
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| Compound Name |
SID131409773
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| Structure |
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| Formula |
C32H47N3O5
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| Molecular Weight |
553.744
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| Canonical SMILES |
CCCN(C)C[C@H]1OCCCC[C@@H](C)Oc2ccc(NC(=O)c3ccccc3)cc2C(=O)N([C@H](C)CO)C[C@H]1C
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| InChI |
InChI=1S/C32H47N3O5/c1-6-17-34(5)21-30-23(2)20-35(24(3)22-36)32(38)28-19-27(33-31(37)26-13-8-7-9-14-26)15-16-29(28)40-25(4)12-10-11-18-39-30/h7-9,13-16,19,23-25,30,36H,6,10-12,17-18,20-22H2,1-5H3,(H,33,37)/t23-,24-,25-,30-/m1/s1
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| InChIKey |
DPWBPPWCHVQSHF-SFOWLQBLSA-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