462641 logo
canSAR462641
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1nc2ccccc2n1C1CC12CC1CCC2N1CC[C@H](NC(=O)C1CCC1)c1ccccc1
    InChI
    InChI=1S/C30H36N4O/c1-20-31-25-12-5-6-13-26(25)34(20)28-19-30(28)18-23-14-15-27(30)33(23)17-16-24(21-8-3-2-4-9-21)32-29(35)22-10-7-11-22/h2-6,8-9,12-13,22-24,27-28H,7,10-11,14-19H2,1H3,(H,32,35)/t23?,24-,27?,28?,30?/m0/s1
    MOLECULAR FORMULA
    C30H36N4O
    CROSS REFERENCES
    462641 logo

    canSAR462641

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 468.29
    AlogP 5.56
    HBond donors 1
    HBond acceptors 5
    Atoms 71
    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 canSAR462641.