General Information of the Compound
| Compound ID |
CP0576199
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| Compound Name |
(13S,16S)-N-[(2S)-4-methyl-1-[(2R)-2-methyloxiran-2-yl]-1-oxopentan-2-yl]-2,5,15-trioxo-11-oxa-1,4,14-triazabicyclo[14.3.0]nonadecane-13-carboxamide
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| Formula |
C25H40N4O7
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| Molecular Weight |
508.616
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| Canonical SMILES |
CC(C)C[C@H](NC(=O)[C@@H]1COCCCCCC(=O)NCC(=O)N2CCC[C@H]2C(=O)N1)C(=O)[C@@]1(C)CO1
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| InChI |
InChI=1S/C25H40N4O7/c1-16(2)12-17(22(32)25(3)15-36-25)27-23(33)18-14-35-11-6-4-5-9-20(30)26-13-21(31)29-10-7-8-19(29)24(34)28-18/h16-19H,4-15H2,1-3H3,(H,26,30)(H,27,33)(H,28,34)/t17-,18-,19-,25+/m0/s1
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| InChIKey |
JUDXKNZMKCCTSY-WSZYKNRRSA-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