canSAR607585
FEATURES
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NAMES
    SMILES
    O=C1CNCCCN2CCN(CCCNCC(=O)Nc3ccc(cc3)S(=O)(=O)c3ccc(cc3)NC(=O)CNCCCN3CCN(CCCNCC(=O)Nc4ccc(cc4)S(=O)(=O)c4ccc(cc4)N1)CC3)CC2
    InChI
    InChI=1S/C52H72N12O8S2/c65-49-37-53-21-1-25-61-29-31-62(32-30-61)26-2-22-54-38-50(66)58-42-9-17-47(18-10-42)74(71,72)48-19-11-44(12-20-48)60-52(68)40-56-24-4-28-64-35-33-63(34-36-64)27-3-23-55-39-51(67)59-43-7-15-46(16-8-43)73(69,70)45-13-5-41(57-49)6-14-45/h5-20,53-56H,1-4,21-40H2,(H,57,65)(H,58,66)(H,59,67)(H,60,68)
    MOLECULAR FORMULA
    C52H72N12O8S2
    CROSS REFERENCES
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    canSAR607585
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1056.50
    AlogP1.97
    HBond donors8
    HBond acceptors20
    Atoms146
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR607585.