1127476 logo
canSAR1127476
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    O=C1OCc2cc([C@@H]3CN4CCN(C(=O)C5CCc6nc(-n7cnnn7)ccc65)C[C@H]4CO3)ccc21
    InChI
    InChI=1S/C25H25N7O4/c33-24(20-3-5-21-19(20)4-6-23(27-21)32-14-26-28-29-32)31-8-7-30-11-22(35-13-17(30)10-31)15-1-2-18-16(9-15)12-36-25(18)34/h1-2,4,6,9,14,17,20,22H,3,5,7-8,10-13H2/t17-,20?,22-/m0/s1
    MOLECULAR FORMULA
    C25H25N7O4
    CROSS REFERENCES
    1127476 logo

    canSAR1127476

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 487.20
    AlogP 1.04
    HBond donors 0
    HBond acceptors 11
    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 canSAR1127476.