General Information of the Compound
| Compound ID |
CP0900330
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| Compound Name |
SID85805158
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| Structure |
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| Formula |
C35H51ClN4O7S
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| Molecular Weight |
707.334
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| Canonical SMILES |
C[C@@H]1CCCCO[C@@H](CN(C)C(=O)NC2CCCCC2)[C@H](C)CN([C@H](C)CO)C(=O)c2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2O1
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| InChI |
InChI=1S/C35H51ClN4O7S/c1-24-21-40(25(2)23-41)34(42)31-20-29(38-48(44,45)30-16-13-27(36)14-17-30)15-18-32(31)47-26(3)10-8-9-19-46-33(24)22-39(4)35(43)37-28-11-6-5-7-12-28/h13-18,20,24-26,28,33,38,41H,5-12,19,21-23H2,1-4H3,(H,37,43)/t24-,25-,26-,33+/m1/s1
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| InChIKey |
NUAKBWXMSMHBBB-WCPDHXNLSA-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