Molecule Info

Ro5 PAINS
SMILES CN(C)c1ccc([C@H](CNC(=O)C(=O)Nc2ccccc2C#N)N2CC[NH+](C)CC2)cc1
InChIKey SZVKVQPVQCASJD-QFIPXVFZSA-O
Molecular Weight 435.25
Calculated LogP 0.25
Hydrogen bond donors 3
Hydrogen bond acceptors 5
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