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canSAR1101522
FEATURES
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NAMES
    SMILES
    O=c1c2ccccc2nc(-c2cccc(OS(=O)(=O)O)c2)n1CCCn1cc(Cn2c(-c3cccc(OS(=O)(=O)O)c3)nc3ccccc3c2=O)nn1
    InChI
    InChI=1S/C34H27N7O10S2/c42-33-27-12-1-3-14-29(27)35-31(22-8-5-10-25(18-22)50-52(44,45)46)40(33)17-7-16-39-20-24(37-38-39)21-41-32(36-30-15-4-2-13-28(30)34(41)43)23-9-6-11-26(19-23)51-53(47,48)49/h1-6,8-15,18-20H,7,16-17,21H2,(H,44,45,46)(H,47,48,49)
    MOLECULAR FORMULA
    C34H27N7O10S2
    CROSS REFERENCES
    1101522 logo

    canSAR1101522

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 757.13
    AlogP 3.53
    HBond donors 2
    HBond acceptors 17
    Atoms 80
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1101522.