1618645 logo
canSAR1618645
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    C[C@@H](c1ccc(-c2ccn(C3CC3)c(=O)c2)cc1)N1CCC(CC(C)(C)C)(CC(C)(C)O)OC1=O
    InChI
    InChI=1S/C29H40N2O4/c1-20(30-16-14-29(35-26(30)33,18-27(2,3)4)19-28(5,6)34)21-7-9-22(10-8-21)23-13-15-31(24-11-12-24)25(32)17-23/h7-10,13,15,17,20,24,34H,11-12,14,16,18-19H2,1-6H3/t20-,29?/m0/s1
    MOLECULAR FORMULA
    C29H40N2O4
    CROSS REFERENCES
    1618645 logo

    canSAR1618645

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 480.30
    AlogP 6.09
    HBond donors 1
    HBond acceptors 6
    Atoms 75
    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 canSAR1618645.