General Information of the Compound
| Compound ID |
CP0060462
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| Compound Name |
4-[(3aS,6aR)-2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl]-6-cyclopentylpyrimidin-2-amine
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| Structure |
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| Formula |
C15H23N5
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| Molecular Weight |
273.384
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| Canonical SMILES |
Nc1nc(cc(n1)N1C[C@@H]2CNC[C@@H]2C1)C1CCCC1
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| InChI |
InChI=1S/C15H23N5/c16-15-18-13(10-3-1-2-4-10)5-14(19-15)20-8-11-6-17-7-12(11)9-20/h5,10-12,17H,1-4,6-9H2,(H2,16,18,19)/t11-,12+
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| InChIKey |
KFFPHZHAEKBUBL-TXEJJXNPSA-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