658429 logo
canSAR658429
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCN(CC)CCCCCCOc1ccc2c(c1)C(=O)/C(=C/c1ccc(CN(C)Cc3ccccc3)cc1)C2
    InChI
    InChI=1S/C35H44N2O2/c1-4-37(5-2)21-11-6-7-12-22-39-33-20-19-31-24-32(35(38)34(31)25-33)23-28-15-17-30(18-16-28)27-36(3)26-29-13-9-8-10-14-29/h8-10,13-20,23,25H,4-7,11-12,21-22,24,26-27H2,1-3H3/b32-23+
    MOLECULAR FORMULA
    C35H44N2O2
    CROSS REFERENCES
    658429 logo

    canSAR658429

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 524.34
    AlogP 7.42
    HBond donors 0
    HBond acceptors 4
    Atoms 83
    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 canSAR658429.