Sanitize It Yourself
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Molecule Info
Ro5
SMILES
COC1=CC(=NC(=C1)C(F)(F)F)C(=O)NC2=CC=CC(=C2)C(C)SC3=NN=C[N]3C
InChIKey
OPBKZNMQEORIOT-UHFFFAOYSA-N
Molecular Weight
437.11
Calculated LogP
4.34
Hydrogen bond donors
1
Hydrogen bond acceptors
7
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