Molecular Identity
Azacytidine
4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3,5-triazin-2-one
PubChem CID: 9444
Azacitidine can cause cancer according to The World Health Organization's International Agency for Research on Cancer (IARC).
2D Structure
Properties
C8H12N4O5
Molecular Formula
244.20
Molecular Weight
g/mol
244.0808
Exact Mass
Da
-2.2
XLogP
Drug-like (Lipinski: < 5)
141
TPSA
May have limited oral absorption
4
H-Bond Donors
5
H-Bond Acceptors
384
Complexity
SMILES
Canonical SMILES
SMILES: C1=NC(=NC(=O)N1C2C(C(C(O2)CO)O)O)NIsomeric SMILES
SMILES: C1=NC(=NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)NSynonyms(20)
5-azacytidineAzacitidine320-67-2AzacytidineLadakamycinMylosar5-azacitidineAzacitidinaAzacitidinumAntibiotic U 18496OnuregU-18496DTXSID9020116NSC 1028164-Amino-1-beta-D-ribofuranosyl-s-triazin-2(1H)-one
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Azacytidine
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