1018913 logo
canSAR1018913
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)[C@H](C[C@H]1CC[C@@H](NCc2ccccc2)CC1)N1CC(=O)Nc2ccc(Oc3ccccc3)cc2C1=O
    InChI
    InChI=1S/C33H39N3O3/c1-23(2)31(19-24-13-15-26(16-14-24)34-21-25-9-5-3-6-10-25)36-22-32(37)35-30-18-17-28(20-29(30)33(36)38)39-27-11-7-4-8-12-27/h3-12,17-18,20,23-24,26,31,34H,13-16,19,21-22H2,1-2H3,(H,35,37)/t24-,26+,31-/m0/s1
    MOLECULAR FORMULA
    C33H39N3O3
    CROSS REFERENCES
    1018913 logo

    canSAR1018913

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 525.30
    AlogP 6.64
    HBond donors 2
    HBond acceptors 6
    Atoms 78
    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 canSAR1018913.