Molecule Info

Ro5 PAINS MCF
SMILES CN(C)c1ccc(/C=C(/C#N)C(=O)c2cccc(C#N)c2)cc1
InChIKey VQNFITQFCDASBS-YVLHZVERSA-N
Molecular Weight 301.12
Calculated LogP 3.41
Hydrogen bond donors 0
Hydrogen bond acceptors 4
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