Molecular Identity
59643-91-3
4-amino-1,3-diazabicyclo[3.1.0]hex-3-en-2-one
PubChem CID: 68791
2D Structure
Properties
C4H5N3O
Molecular Formula
111.10
Molecular Weight
g/mol
111.0433
Exact Mass
Da
-1.4
XLogP
Drug-like (Lipinski: < 5)
58.5
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
1
H-Bond Acceptors
186
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
59643-91-3BM-060024-Amino-1,3-diazabicyclo[3.1.0]hex-3-en-2-one4-Imino-1,3-diazabicyclo(3.1.0)hexan-2-oneDTXSID1046895NSC-313425DTXCID90268954-Imino-1,3-diazabicyclo[3.1.0]hexan-2-one4-Amino-1,3-diazabicyclo(3.1.0)hex-3-en-2-oneNSC714597RefChem:7906144-imino-1,3-diazabicyclo(3,1,0)-hexan-2-one261-838-28F63U28T2VAmplimexon
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 59643-91-3
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