Lunresertib
2-amino-1-(3-hydroxy-2,6-dimethylphenyl)-5,6-dimethylpyrrolo[2,3-b]pyridine-3-carboxamide
Molecular Identity
Lunresertib
2-amino-1-(3-hydroxy-2,6-dimethylphenyl)-5,6-dimethylpyrrolo[2,3-b]pyridine-3-carboxamide
PubChem CID: 156869388
2D Structure
Properties
C18H20N4O2
Molecular Formula
324.40
Molecular Weight
g/mol
324.1586
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
107
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
4
H-Bond Acceptors
488
Complexity
SMILES
Canonical SMILES
SMILES: CC1=C(C(=C(C=C1)O)C)N2C(=C(C3=C2N=C(C(=C3)C)C)C(=O)N)NIsomeric SMILES
SMILES: CC1=C(C(=C(C=C1)O)C)N2C(=C(C3=C2N=C(C(=C3)C)C)C(=O)N)NSynonyms(20)
RP-63062719793-90-3lunresertibN95U3A7N572-Amino-1-(3-hydroxy-2,6-dimethylphenyl)-5,6-dimethylpyrrolo[2,3-b]pyridine-3-carboxamide2-amino-1-(3-hydroxy-2,6-dimethylphenyl)-5,6-dimethylpyrrolo(2,3-b)pyridine-3-carboxamideRefChem:1088589(Rac)-RP-63062719749-28-5(R)-RP-6306RP63062719793-91-4CHEMBL51990762-Amino-1-(3-hydroxy-2,6-dimethylphenyl)-5,6-dimethyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamideLunresertib (USAN)
Data from PubChem (NCBI)
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