1144073 logo
canSAR1144073
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@]12CC[C@@](C)(CC(=O)N(c1ccccc1)C(C)(C)C(=O)Nc1c(C)cccc1C)O2
    InChI
    InChI=1S/C38H52N2O3/c1-26-15-13-16-27(2)32(26)39-33(42)35(6,7)40(29-17-11-10-12-18-29)31(41)25-36(8)23-24-38(43-36)28(3)19-20-30-34(4,5)21-14-22-37(30,38)9/h10-13,15-19,30H,14,20-25H2,1-9H3,(H,39,42)/t30-,36-,37-,38+/m0/s1
    MOLECULAR FORMULA
    C38H52N2O3
    CROSS REFERENCES
    1144073 logo

    canSAR1144073

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 584.40
    AlogP 8.93
    HBond donors 1
    HBond acceptors 5
    Atoms 95
    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 canSAR1144073.