5987 1 2 3 4 5 6 7 8 16 8 8 8 7 1 1 1 1 1 1 1 2 5 5 2 3 4 5 8 6 7 1 2 2 1 1 1 1 1 5 255 1 2 3 4 5 6 7 8 3.403 4.269 2.903 3.903 2.5369 2 2.5369 4.8059 0.127 0.627 0.993 -0.739 -0.373 -0.063 -0.993 0.317 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 92.6 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 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 00000371000230004000000000000000000000000000000000000000000000000000000000000000001048000000000000000000000000800000000000300000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 sulfamic acid IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 sulfamic acid IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 sulfamic acid IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 sulfamic acid IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 sulfamic acid IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 sulfamic acid InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4) InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 IIACRCGMVDHOTQ-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 -1.6 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 96.98336413 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 H3NO3S Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 97.10 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 NS(=O)(=O)O SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 NS(=O)(=O)O Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 88.8 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 96.98336413 5 0 0 0 0 0 0 0 1 -1