General Information of the Compound
| Compound ID |
CP0086299
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| Compound Name |
1-[(2S,4S)-4-azido-2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl]-4-phenylbutan-1-one
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| Structure |
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| Formula |
C19H25N5O2
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| Molecular Weight |
355.442
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| Canonical SMILES |
[N-]=[N+]=N[C@H]1C[C@H](N(C1)C(=O)CCCc1ccccc1)C(=O)N1CCCC1
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| InChI |
InChI=1S/C19H25N5O2/c20-22-21-16-13-17(19(26)23-11-4-5-12-23)24(14-16)18(25)10-6-9-15-7-2-1-3-8-15/h1-3,7-8,16-17H,4-6,9-14H2/t16-,17-/m0/s1
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| InChIKey |
COFDNGGDLKZPRK-IRXDYDNUSA-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