Sanitize It Yourself
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Molecule Info
Ro5
SMILES
CC(SC1=NN=C[N]1C)C2=CC(=CC=C2)C3=CC(=NO3)C4=CC=C(C=C4)C#N
InChIKey
FPYAUEVSZDLVGT-UHFFFAOYSA-N
Molecular Weight
387.12
Calculated LogP
4.86
Hydrogen bond donors
0
Hydrogen bond acceptors
7
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