General Information of the Compound
| Compound ID |
CP0452219
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| Compound Name |
(2S)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-2-[[(2R)-5-oxopyrrolidin-2-yl]methylamino]-3-phenylpropanamide
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| Structure |
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| Formula |
C24H25N5O3
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| Molecular Weight |
431.496
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| Canonical SMILES |
O=C(Nc1cc(c[nH]c1=O)-c1ccncc1)[C@H](Cc1ccccc1)NC[C@H]1CCC(=O)N1
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| InChI |
InChI=1S/C24H25N5O3/c30-22-7-6-19(28-22)15-26-20(12-16-4-2-1-3-5-16)24(32)29-21-13-18(14-27-23(21)31)17-8-10-25-11-9-17/h1-5,8-11,13-14,19-20,26H,6-7,12,15H2,(H,27,31)(H,28,30)(H,29,32)/t19-,20+/m1/s1
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| InChIKey |
BNZPVFLWMDGDAP-UXHICEINSA-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