General Information of the Compound
| Compound ID |
CP0947494
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| Compound Name |
[2-(5-Methyl-1H-pyrazol-4-yl)-thieno[3,2-d]pyrimidin-4-yl]-(R)-pyrrolidin-3-yl-amine
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| Structure |
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| Formula |
C14H16N6S
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| Molecular Weight |
300.391
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| Canonical SMILES |
Cc1[nH]ncc1-c1nc(N[C@@H]2CCNC2)c2sccc2n1
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| InChI |
InChI=1S/C14H16N6S/c1-8-10(7-16-20-8)13-18-11-3-5-21-12(11)14(19-13)17-9-2-4-15-6-9/h3,5,7,9,15H,2,4,6H2,1H3,(H,16,20)(H,17,18,19)/t9-/m1/s1
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| InChIKey |
SOGUUUWAKMZIBD-SECBINFHSA-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