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canSAR1015363
FEATURES
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NAMES
    SMILES
    CC1(C)CC2(CCCN(C3CCN(C(=O)c4c(NC(=O)NC5CCCCC5)sc5ccccc45)CC3)C2)C(=O)O1
    InChI
    InChI=1S/C31H42N4O4S/c1-30(2)19-31(28(37)39-30)15-8-16-35(20-31)22-13-17-34(18-14-22)27(36)25-23-11-6-7-12-24(23)40-26(25)33-29(38)32-21-9-4-3-5-10-21/h6-7,11-12,21-22H,3-5,8-10,13-20H2,1-2H3,(H2,32,33,38)
    MOLECULAR FORMULA
    C31H42N4O4S
    CROSS REFERENCES
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    canSAR1015363

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 566.29
    AlogP 5.77
    HBond donors 2
    HBond acceptors 8
    Atoms 82
    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 canSAR1015363.