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canSAR1065608
FEATURES
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NAMES
    SMILES
    CC(C)[C@@H](OC(=O)N(C)C)[C@H]1C[C@@H](C)[C@H]2[C@H](O1)[C@H](O)[C@@]1(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](OC(=O)N5CCC5)CC[C@@]45C[C@@]35CC[C@]21C
    InChI
    InChI=1S/C37H60N2O6/c1-21(2)28(45-31(41)38(8)9)23-19-22(3)27-29(43-23)30(40)35(7)25-12-11-24-33(4,5)26(44-32(42)39-17-10-18-39)13-14-36(24)20-37(25,36)16-15-34(27,35)6/h21-30,40H,10-20H2,1-9H3/t22-,23-,24+,25+,26+,27+,28-,29+,30+,34-,35-,36-,37+/m1/s1
    MOLECULAR FORMULA
    C37H60N2O6
    CROSS REFERENCES
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    canSAR1065608

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 628.45
    AlogP 6.73
    HBond donors 1
    HBond acceptors 8
    Atoms 105
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1065608.