5493006 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 17 8 7 7 7 7 7 7 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 2 3 3 3 4 4 5 6 6 7 7 8 8 8 9 10 11 11 11 12 12 12 14 25 13 4 11 12 5 15 9 9 14 10 14 13 23 24 10 13 16 17 18 19 20 21 22 1 2 1 1 1 1 1 2 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 5 -1 4 9 6 10 1 1 1 5 255 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 2.263 3.2569 1.2039 2.155 2.3629 3.6229 4.9319 4.989 3.3139 4.1229 0.4608 0.996 4.1229 4.6229 2.6157 0.0459 0 0.8756 1.6024 0.8671 0.3895 4.9874 4.989 5.5259 3.263 0 6.0404 5.5488 5.2398 4.2617 3.0016 3.9526 6.0404 3.9526 4.5404 4.8797 6.527 5.5404 3.0016 5.6547 5.3404 4.4648 4.419 6.6559 7.1334 6.3981 2.5 6.6604 5.7304 0 0 Compound Canonicalized 5 2007.06.29 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 302 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 4 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 3 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 3 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371C063A000040000000000000000000000000100000000000000000000000000000000001E001800000008080180040300024200002801033134000000010000000020012800000000080040000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 (5E)-5-(dimethylaminohydrazono)imidazole-4-carboxamide;hydrochloride IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 (5E)-5-(dimethylaminohydrazinylidene)-4-imidazolecarboxamide;hydrochloride IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 (5<I>E</I>)-5-(dimethylaminohydrazinylidene)imidazole-4-carboxamide;hydrochloride IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 (5E)-5-(dimethylaminohydrazinylidene)imidazole-4-carboxamide;hydrochloride IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 (5E)-5-(dimethylaminohydrazinylidene)imidazole-4-carboxamide;hydrochloride IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 (5E)-5-(dimethylaminohydrazono)imidazole-4-carboxamide;hydrochloride InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/C6H10N6O.ClH/c1-12(2)11-10-6-4(5(7)13)8-3-9-6;/h3,11H,1-2H3,(H2,7,13);1H/b10-6+; InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 HNNMOGQRQFPYBM-AAGWESIMSA-N Log P XLogP 7 E_XLOGP 3.328 Cactvs xemistry.com 2006.08.14 0.798 Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 218.0682867 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 C6H11ClN6O Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 218.64 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 CN(C)NN=C1C(=NC=N1)C(=O)N.Cl SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 CN(C)N/N=C/1\C(=NC=N1)C(=O)N.Cl Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 95.4 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 218.0682867 14 0 0 0 1 1 0 0 2 -1