58975656 1 2 97 97 1 2 6 1 5 255 1 2 2 3 0 0 0 Compound Canonicalized 5 2012.05.21 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 berkelium IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 berkelium IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 berkelium IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 berkelium IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 berkelium IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 berkelium InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/2Bk InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 FTESYAOZAIHDQQ-UHFFFAOYSA-N Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 494.1406 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 Bk2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.08.13 494.14061 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 [Bk].[Bk] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 [Bk].[Bk] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 494.1406 2 0 0 0 0 0 0 0 2 -1