canSAR705644
FEATURES
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NAMES
    SMILES
    N#Cc1c(-c2ccccc2)nc(SCc2nc3ccccc3[nH]2)nc1N1CCN(C(=O)c2ccccc2)CC1
    InChI
    InChI=1S/C30H25N7OS/c31-19-23-27(21-9-3-1-4-10-21)34-30(39-20-26-32-24-13-7-8-14-25(24)33-26)35-28(23)36-15-17-37(18-16-36)29(38)22-11-5-2-6-12-22/h1-14H,15-18,20H2,(H,32,33)
    MOLECULAR FORMULA
    C30H25N7OS
    CROSS REFERENCES
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    canSAR705644
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight531.18
    AlogP5.15
    HBond donors1
    HBond acceptors8
    Atoms64
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR705644.