166718 1 2 3 4 5 16 16 16 1 1 1 1 2 3 2 3 4 5 1 1 1 1 1 5 255 1 2 3 4 5 3.403 4.269 2.5369 4.8059 2 -0.25 0.25 0.25 -0.06 -0.06 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 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 00000371000000006000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/H2S3/c1-3-2/h1-2H InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 KBMBVTRWEAAZEY-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 1.4 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 97.93186358 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 H2S3 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 98.2 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 SSS SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 SSS Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 27.3 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 97.93186358 3 0 0 0 0 0 0 0 1 -1