General Information of the Compound
| Compound ID |
CP0351150
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| Compound Name |
(14S,17S)-N-[(2S)-4-methyl-1-[(2R)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]-2,5,16-trioxo-12-oxa-1,4,15-triazabicyclo[15.3.0]icosane-14-carboxamide
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| Formula |
C26H42N4O7
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| Molecular Weight |
522.643
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| Canonical SMILES |
CC(C)C[C@H](NC(=O)[C@@H]1COCCCCCCC(=O)NCC(=O)N2CCC[C@H]2C(=O)N1)C(=O)[C@@]1(C)CO1
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| InChI |
InChI=1S/C26H42N4O7/c1-17(2)13-18(23(33)26(3)16-37-26)28-24(34)19-15-36-12-7-5-4-6-10-21(31)27-14-22(32)30-11-8-9-20(30)25(35)29-19/h17-20H,4-16H2,1-3H3,(H,27,31)(H,28,34)(H,29,35)/t18-,19-,20-,26+/m0/s1
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| InChIKey |
FQXFPJCBQXLSMF-XNCCSTQDSA-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