Molecules/1-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-amino-3-pyridinyl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
1-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-amino-3-pyridinyl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
1-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-amino-3-pyridinyl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
Molecular Identity
1-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-amino-3-pyridinyl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
1-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-amino-3-pyridinyl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
PubChem CID: 135311801
2D Structure
Properties
C15H19N9O5S2
Molecular Formula
469.50
Molecular Weight
g/mol
469.0951
Exact Mass
Da
-2.7
XLogP
Drug-like (Lipinski: < 5)
263
TPSA
May have limited oral absorption
6
H-Bond Donors
13
H-Bond Acceptors
803
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC(=NC=C1C2=C(C(=C(C=C2)S(=O)(=O)NCC(CN)O)S(=O)(=O)N)C3=NNN=N3)NIsomeric SMILES
SMILES: C1=CC(=NC=C1C2=C(C(=C(C=C2)S(=O)(=O)NC[C@@H](CN)O)S(=O)(=O)N)C3=NNN=N3)NSynonyms(13)
MK-34022058151-78-1orb1744171CHEMBL6052432SCHEMBL20480486EX-A8592MK-3402 FREE BASE ANHYDROUSDSX5065990BM183692HY-148493CS-0628559T734381-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-aminopyridin-3-yl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
Data from PubChem (NCBI)
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Molecular Structure
1-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-amino-3-pyridinyl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
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Drug Network
Trials and conditions connected to 1-N-[(2R)-3-amino-2-hydroxypropyl]-4-(6-amino-3-pyridinyl)-3-(2H-tetrazol-5-yl)benzene-1,2-disulfonamide
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