747698 logo
canSAR747698
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccc2c(c1)C(=O)N(CC(C)(C)CNCCCCCCNCCCN1C(=O)c3ccccc3C1=O)C2=O
    InChI
    InChI=1S/C31H40N4O4/c1-22-13-14-25-26(19-22)30(39)35(29(25)38)21-31(2,3)20-33-16-9-5-4-8-15-32-17-10-18-34-27(36)23-11-6-7-12-24(23)28(34)37/h6-7,11-14,19,32-33H,4-5,8-10,15-18,20-21H2,1-3H3
    MOLECULAR FORMULA
    C31H40N4O4
    CROSS REFERENCES
    747698 logo

    canSAR747698

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 532.30
    AlogP 4.04
    HBond donors 2
    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 canSAR747698.