561373 logo
canSAR561373
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCNc1cc(C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CNCCc2ccccc2)cc(N2CCCC2=O)c1
    InChI
    InChI=1S/C31H38N4O3/c1-2-33-26-19-25(20-27(21-26)35-17-9-14-30(35)37)31(38)34-28(18-24-12-7-4-8-13-24)29(36)22-32-16-15-23-10-5-3-6-11-23/h3-8,10-13,19-21,28-29,32-33,36H,2,9,14-18,22H2,1H3,(H,34,38)/t28-,29+/m0/s1
    MOLECULAR FORMULA
    C31H38N4O3
    CROSS REFERENCES
    561373 logo

    canSAR561373

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 514.29
    AlogP 3.78
    HBond donors 4
    HBond acceptors 7
    Atoms 76
    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 canSAR561373.