1207279 logo
canSAR1207279
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(OC)c2ccn(CCCCCCCC[C@H]3CCC[C@]4(CC[C@H](C)O4)O3)c2c1
    InChI
    InChI=1S/C27H41NO4/c1-21-13-16-27(31-21)15-10-12-22(32-27)11-8-6-4-5-7-9-17-28-18-14-24-25(28)19-23(29-2)20-26(24)30-3/h14,18-22H,4-13,15-17H2,1-3H3/t21-,22-,27+/m0/s1
    MOLECULAR FORMULA
    C27H41NO4
    CROSS REFERENCES
    1207279 logo

    canSAR1207279

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 443.30
    AlogP 6.85
    HBond donors 0
    HBond acceptors 5
    Atoms 73
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1207279.