canSAR1584348
FEATURES
Loading...
NAMES
    SMILES
    CC#CCn1c(N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)nc2c1c(=O)n(CC(=O)c1cccc(OC3CC3)c1)c(=O)n2C
    InChI
    InChI=1S/C31H38N6O6/c1-6-7-16-36-25-26(33-28(36)35-15-9-11-21(18-35)32-29(40)43-31(2,3)4)34(5)30(41)37(27(25)39)19-24(38)20-10-8-12-23(17-20)42-22-13-14-22/h8,10,12,17,21-22H,9,11,13-16,18-19H2,1-5H3,(H,32,40)/t21-/m1/s1
    MOLECULAR FORMULA
    C31H38N6O6
    CROSS REFERENCES
    Loading...
    canSAR1584348
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight590.29
    AlogP2.84
    HBond donors1
    HBond acceptors12
    Atoms81
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1584348.