Sanitize It Yourself
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Molecule Info
Ro5
SMILES
CC(O)CNC1=CC(=CC(=N1)N2CC3=C(C=CC=C3C(F)(F)F)C2=O)C(C)SC4=NN=C[N]4C
InChIKey
KAMSFNXDOCOIHG-UHFFFAOYSA-N
Molecular Weight
492.16
Calculated LogP
4.04
Hydrogen bond donors
2
Hydrogen bond acceptors
8
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