832071 logo
canSAR832071
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)(C)c1ccc(-c2ccc(CCC(=O)N3CCC[C@H]3c3ncc(-c4ccccc4)[nH]3)cc2)cc1
    InChI
    InChI=1S/C32H35N3O/c1-32(2,3)27-18-16-25(17-19-27)24-14-11-23(12-15-24)13-20-30(36)35-21-7-10-29(35)31-33-22-28(34-31)26-8-5-4-6-9-26/h4-6,8-9,11-12,14-19,22,29H,7,10,13,20-21H2,1-3H3,(H,33,34)/t29-/m0/s1
    MOLECULAR FORMULA
    C32H35N3O
    CROSS REFERENCES
    832071 logo

    canSAR832071

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 477.28
    AlogP 7.34
    HBond donors 1
    HBond acceptors 4
    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 canSAR832071.