canSAR738907
FEATURES
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NAMES
    SMILES
    CC(C)n1cnc2c(NCc3ccc(-c4ccccc4Cl)cc3)nc(N[C@H]3CC[C@H](N)CC3)nc21
    InChI
    InChI=1S/C27H32ClN7/c1-17(2)35-16-31-24-25(33-27(34-26(24)35)32-21-13-11-20(29)12-14-21)30-15-18-7-9-19(10-8-18)22-5-3-4-6-23(22)28/h3-10,16-17,20-21H,11-15,29H2,1-2H3,(H2,30,32,33,34)/t20-,21-
    MOLECULAR FORMULA
    C27H32ClN7
    CROSS REFERENCES
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    canSAR738907
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight489.24
    AlogP6.02
    HBond donors4
    HBond acceptors7
    Atoms67
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR738907.