831001 logo
canSAR831001
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CN1c2ccc(OC(=O)Nc3ccccc3)cc2[C@]2(C)CCN(CCc3ccccc3)[C@H]12
    InChI
    InChI=1S/C27H29N3O2/c1-27-16-18-30(17-15-20-9-5-3-6-10-20)25(27)29(2)24-14-13-22(19-23(24)27)32-26(31)28-21-11-7-4-8-12-21/h3-14,19,25H,15-18H2,1-2H3,(H,28,31)/t25-,27-/m0/s1
    MOLECULAR FORMULA
    C27H29N3O2
    CROSS REFERENCES
    831001 logo

    canSAR831001

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 427.23
    AlogP 5.28
    HBond donors 1
    HBond acceptors 5
    Atoms 61
    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 canSAR831001.