General Information of the Compound
| Compound ID |
CP0951764
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| Compound Name |
(3S,4S)-4-(2-Pyridin-4-yl-thieno[3,2-d]pyrimidin-4-ylamino)-pyrrolidin-3-ol
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| Structure |
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| Formula |
C15H15N5OS
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| Molecular Weight |
313.386
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| Canonical SMILES |
O[C@H]1CNC[C@@H]1Nc1nc(-c2ccncc2)nc2ccsc12
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| InChI |
InChI=1S/C15H15N5OS/c21-12-8-17-7-11(12)19-15-13-10(3-6-22-13)18-14(20-15)9-1-4-16-5-2-9/h1-6,11-12,17,21H,7-8H2,(H,18,19,20)/t11-,12-/m0/s1
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| InChIKey |
ZKIPEXFNOAVOAV-RYUDHWBXSA-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