750 1 2 3 4 5 6 7 8 9 10 8 8 7 6 6 1 1 1 1 1 1 1 2 3 3 3 4 4 4 5 10 5 4 8 9 5 6 7 1 1 2 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 2.5369 3.403 5.135 4.269 3.403 4.6675 3.8705 5.672 5.135 2 0.75 -0.75 0.25 0.75 0.25 1.225 1.225 0.56 -0.37 0.44 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.384 Cactvs xemistry.com 2011.09.13 42.9 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.384 Cactvs xemistry.com 2011.09.13 3 Count Hydrogen Bond Donor 5 E_NHDONORS 3.384 Cactvs xemistry.com 2011.09.13 2 Count Rotatable Bond 5 E_NROTBONDS 3.384 Cactvs xemistry.com 2011.09.13 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.384 Cactvs xemistry.com 2011.09.13 0000037180423000000000000000000000000000000000000000000000000000000000000000001E00100800000000C180040008004002000800009008000000000000000000808000000200000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.0.2 LexiChem openeye.com 2011.09.13 2-aminoacetic acid IUPAC Name CAS-like Style 1 2.0.2 LexiChem openeye.com 2011.09.13 2-aminoacetic acid IUPAC Name Preferred 1 2.0.2 LexiChem openeye.com 2011.09.13 2-aminoacetic acid IUPAC Name Systematic 1 2.0.2 LexiChem openeye.com 2011.09.13 2-azanylethanoic acid IUPAC Name Traditional 1 2.0.2 LexiChem openeye.com 2011.09.13 2-aminoacetic acid InChI Standard 1 1.0.3 InChI nist.gov 2011.09.13 InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5) InChIKey Standard 1 1.0.3 InChI nist.gov 2011.09.13 DHMQDGOQFOQNFH-UHFFFAOYSA-N Log P XLogP3 7 3.0 sioc-ccbg.ac.cn 2011.09.13 -3.2 Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 75.032028 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 C2H5NO2 Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 75.0666 SMILES Canonical 1 1.7.4 OEChem openeye.com 2011.09.13 C(C(=O)O)N SMILES Isomeric 1 1.7.4 OEChem openeye.com 2011.09.13 C(C(=O)O)N Topological Polar Surface Area 7 E_TPSA 3.384 Cactvs xemistry.com 2011.09.13 63.3 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2011.09.13 75.032028 5 0 0 0 0 0 0 0 1 1