831344 logo
canSAR831344
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CO[C@H]1[C@@H](N(C)C(=O)C2CCCCC2)C[C@@H]2O[C@@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4
    InChI
    InChI=1S/C35H36N4O4/c1-35-32(42-3)25(37(2)34(41)19-11-5-4-6-12-19)17-26(43-35)38-23-15-9-7-13-20(23)28-29-22(18-36-33(29)40)27-21-14-8-10-16-24(21)39(35)31(27)30(28)38/h7-10,13-16,19,25-26,32H,4-6,11-12,17-18H2,1-3H3,(H,36,40)/t25-,26-,32-,35+/m0/s1
    MOLECULAR FORMULA
    C35H36N4O4
    CROSS REFERENCES
    831344 logo

    canSAR831344

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 576.27
    AlogP 6.17
    HBond donors 1
    HBond acceptors 8
    Atoms 79
    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 canSAR831344.