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canSAR780327
FEATURES
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NAMES
    SMILES
    CC1=C2C[C@H]3[C@@H](CC[C@@H]4Cc5nc(C)sc5C[C@]34C)[C@@H]2CC[C@@]2(C1)O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C
    InChI
    InChI=1S/C30H44N2OS/c1-16-10-26-28(31-15-16)18(3)30(33-26)9-8-21-22-7-6-20-11-25-27(34-19(4)32-25)14-29(20,5)24(22)12-23(21)17(2)13-30/h16,18,20-22,24,26,28,31H,6-15H2,1-5H3/t16-,18+,20+,21-,22-,24-,26+,28-,29-,30-/m0/s1
    MOLECULAR FORMULA
    C30H44N2OS
    CROSS REFERENCES
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    canSAR780327

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.32
    AlogP 6.49
    HBond donors 1
    HBond acceptors 3
    Atoms 78
    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 canSAR780327.