Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

752724 - Overview - Compound Synopsis

Synonyms
BH4DAPROTERIN
DaproterinH4B
SAPROPTERINSapropterin
THB
Molecular Formula
C9H15N5O3
InChI
InChI=1S/C9H15N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h3-4,6,12,15-16H,2H2,1H3,(H4,10,11,13,14,17)/t3-,4+,6-/m0/s1
Smiles
C[C@H](O)[C@H](O)[C@H]1CNc2nc(N)nc(O)c2N1
Cross References
UniChem603785
canSAR752724
PDBe (Protein Data Bank Europe)H4B
ChEMBLCHEMBL1201774
BindingDB50373697
PDBe (Protein Data Bank Europe)BH4
PDBe (Protein Data Bank Europe)THB
Commercially Available
Yes
Protein Targets


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 241.11748934-1.28797832No


Compound Lineages


Dosed Drug / Tested Compound(s)Free Compound Form(s)Active Form(s)






Dosed Drug / Tested Compound(s)Free Compound Form(s)Active Form(s)