1833439 logo
canSAR1833439
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(-c2noc(C)c2C(=O)NCC[C@@H]2CCCN2C)cc(OC)c1OC
    InChI
    InChI=1S/C21H29N3O5/c1-13-18(21(25)22-9-8-15-7-6-10-24(15)2)19(23-29-13)14-11-16(26-3)20(28-5)17(12-14)27-4/h11-12,15H,6-10H2,1-5H3,(H,22,25)/t15-/m0/s1
    MOLECULAR FORMULA
    C21H29N3O5
    CROSS REFERENCES
    1833439 logo

    canSAR1833439

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 403.21
    AlogP 2.89
    HBond donors 1
    HBond acceptors 8
    Atoms 58
    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 canSAR1833439.