Ck-2127107
1-[2-[[3-fluoro-1-(3-fluoro-2-pyridinyl)cyclobutyl]methylamino]pyrimidin-5-yl]pyrrole-3-carboxamide
Molecular Identity
Ck-2127107
1-[2-[[3-fluoro-1-(3-fluoro-2-pyridinyl)cyclobutyl]methylamino]pyrimidin-5-yl]pyrrole-3-carboxamide
PubChem CID: 67454400
2D Structure
Properties
C19H18F2N6O
Molecular Formula
384.40
Molecular Weight
g/mol
384.1510
Exact Mass
Da
1.5
XLogP
Drug-like (Lipinski: < 5)
98.7
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
553
Complexity
SMILES
Canonical SMILES
SMILES: C1C(CC1(CNC2=NC=C(C=N2)N3C=CC(=C3)C(=O)N)C4=C(C=CC=N4)F)FIsomeric SMILES
SMILES: C1C(CC1(CNC2=NC=C(C=N2)N3C=CC(=C3)C(=O)N)C4=C(C=CC=N4)F)FSynonyms(20)
CK-2127107RefChem:200207Reldesemtiv1345410-31-2Reldesemtiv [USAN]4S0HBYW6QEReldesemtiv (USAN)1-[2-[[3-fluoro-1-(3-fluoropyridin-2-yl)cyclobutyl]methylamino]pyrimidin-5-yl]pyrrole-3-carboxamide1H-Pyrrole-3-carboxamide, 1-(2-(((trans-3-fluoro-1-(3-fluoro-2-pyridinyl)cyclobutyl)methyl)amino)-5-pyrimidinyl)-Reldesemtiv [WHO-DD]UNII-4S0HBYW6QERELDESEMTIV [INN]orb1706729SCHEMBL2566240CHEMBL4297600
Data from PubChem (NCBI)
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Drug Network
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