[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID
[(isoquinolin-1-ylamino)-phosphonomethyl]phosphonic acid
Molecular Identity
[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID
[(isoquinolin-1-ylamino)-phosphonomethyl]phosphonic acid
PubChem CID: 405731
2D Structure
Properties
C10H12N2O6P2
Molecular Formula
318.16
Molecular Weight
g/mol
318.0171
Exact Mass
Da
-1
XLogP
Drug-like (Lipinski: < 5)
140
TPSA
May have limited oral absorption
5
H-Bond Donors
8
H-Bond Acceptors
413
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(13)
[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACIDCHEMBL2917271t1rIMB[(isoquinolin-1-ylamino)methanediyl]bis(phosphonic acid)(3-ISOQUINOLYLAMINE) METHYLENE-1,1-BISPHOSPHONATEBDBM50135835NSC723273NSC-723273(3-isoquinolylamine)methylene-1,1-bisphosphonate1-[(Bis-phosphono-methyl)-amino]-isoquinolinium(Isoquinolin-1-Ylamino)Methylenediphosphonic AcidQ27461456
Data from PubChem (NCBI)
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Molecular Structure
[(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID
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Drug Network
Trials and conditions connected to [(ISOQUINOLIN-1-YLAMINO)-PHOSPHONO-METHYL]-PHOSPHONIC ACID
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