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canSAR1769419
FEATURES
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NAMES
    SMILES
    O=C(O)CCN1CCC[C@H]1Cc1nc2ccccc2n1[C@@H]1C[C@@H]2CCC[C@H](C1)N2[C@H]1C[C@H]2CCCC[C@H](C2)C1
    InChI
    InChI=1S/C33H48N4O2/c38-33(39)14-16-35-15-6-11-25(35)22-32-34-30-12-3-4-13-31(30)37(32)29-20-26-9-5-10-27(21-29)36(26)28-18-23-7-1-2-8-24(17-23)19-28/h3-4,12-13,23-29H,1-2,5-11,14-22H2,(H,38,39)/t23-,24+,25-,26-,27+,28-,29+/m0/s1
    MOLECULAR FORMULA
    C33H48N4O2
    CROSS REFERENCES
    1769419 logo

    canSAR1769419

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 532.38
    AlogP 6.43
    HBond donors 1
    HBond acceptors 6
    Atoms 87
    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 canSAR1769419.