3657 1 2 3 4 5 6 7 8 9 8 8 7 7 6 1 1 1 1 1 1 2 3 3 4 4 4 3 9 5 5 6 5 7 8 1 1 2 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 9 5.135 3.403 4.269 2.5369 3.403 4.269 2 2.5369 5.672 -0.06 -1.06 0.44 0.44 -0.06 1.06 0.13 1.06 0.25 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 42.9 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371800330000000000000000000000000000000000000000000000000000000000000000006001408000000000000000100005000000800000010000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydroxyurea IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydroxyurea IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydroxyurea IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydroxyurea IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 1-oxidanylurea IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydroxyurea InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/CH4N2O2/c2-1(4)3-5/h5H,(H3,2,3,4) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 VSNHCAURESNICA-UHFFFAOYSA-N Log P XLogP3 7 3.0 sioc-ccbg.ac.cn 2021.10.14 -1.8 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 76.027277375 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 CH4N2O2 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 76.055 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(=O)(N)NO SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(=O)(N)NO Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 75.4 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 76.027277375 5 0 0 0 0 0 0 0 1 -1