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Gene Set: D4 : Boss - (r)-rolipram

Collection D4 : Boss
Chemical Name (r)-rolipram ( From PubChem : (R)-(-)-ROLIPRAM )
FDA NPC WHO Indian Australia China Traditional
Herbal		 Clinical
Trail
NotNotNotNotNotNotNotNot
Molecular
Weight		 Hydrogen Bond
Donor Count		 Hydrogen Bond
Acceptor Count		 cLogP Lipinski Rule
275.343 g/mol 1 4 2.9489 True
Structure
InChI InChI=1S/C16H21NO3/c1-19-14-7-6-11(12-9-16(18)17-10-12)8-15(14)20-13-4-2-3-5-13/h6-8,12-13H,2-5,9-10H2,1H3,(H,17,18)/t12-/m0/s1
InChIKey HJORMJIFDVBMOB-LBPRGKRZSA-N
Links

Gene (5 / 12)


⊖ Less
Source Type Unit Value Gene PMID Assay Other
BOSSText MiningPDE4A
PubChem NoneuMCYP1A2-GI(Protien) :
PubChem NoneuMCYP1A2-GI(Protien) :
PubChem PotencyuM39.811CYP3A4-GI(Protien) :
PubChem NoneuMCYP3A4-GI(Protien) :
PubChem NoneuMPDE4B-GI(Protien) :
ChEMBLPotencynM28.200CREBBP
-Target : CHEMBL5747
ChEMBLAC50nM3981.070CYP1A2
-Target : CHEMBL3356
ChEMBLAC50nM2511.890CYP1A2
-Target : CHEMBL3356
ChEMBLAC50nM3162.280CYP1A2
-Target : CHEMBL3356
ChEMBLPotencynM39810.700CYP3A4
-Target : CHEMBL340
ChEMBLAC50nM39810.700CYP3A4
-Target : CHEMBL340
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