620-61-1 Purity
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Specification
The molecular weight of Vabicaserin is 228.33 g/mol.
The IUPAC name of Vabicaserin is (12R,16S)-7,10-diazatetracyclo[8.6.1.0 5,17 .0 12,16 ]heptadeca-1,3,5(17)-triene.
The InChIKey of Vabicaserin is NPTIPEQJIDTVKR-STQMWFEESA-N.
The canonical SMILES of Vabicaserin is C1CC2CN3CCNCC4=C3C(=CC=C4)C2C1.
Vabicaserin has 1 hydrogen bond donor count.
Vabicaserin has 2 hydrogen bond acceptor counts.
The topological polar surface area of Vabicaserin is 15.3 Ų.
Vabicaserin has 17 heavy atoms.
Vabicaserin has 2 defined atom stereocenter counts.
The complexity value of Vabicaserin is 291.