1015885 logo
canSAR1015885
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C(NCc1ccnc2ccccc12)c1ccc(Oc2ccc(C#C[C@]3(O)CN4CCC3CC4)cc2)cc1
    InChI
    InChI=1S/C32H29N3O3/c36-31(34-21-25-14-18-33-30-4-2-1-3-29(25)30)24-7-11-28(12-8-24)38-27-9-5-23(6-10-27)13-17-32(37)22-35-19-15-26(32)16-20-35/h1-12,14,18,26,37H,15-16,19-22H2,(H,34,36)/t32-/m0/s1
    MOLECULAR FORMULA
    C32H29N3O3
    CROSS REFERENCES
    1015885 logo

    canSAR1015885

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 503.22
    AlogP 4.77
    HBond donors 2
    HBond acceptors 6
    Atoms 67
    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 canSAR1015885.