1528275 logo
canSAR1528275
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC1(CNC(=O)[C@H](CN)NC(=O)c2ccc(C#CC#Cc3ccccc3)cc2)NC(=O)NC1=O
    InChI
    InChI=1S/C25H23N5O4/c1-25(23(33)29-24(34)30-25)16-27-22(32)20(15-26)28-21(31)19-13-11-18(12-14-19)10-6-5-9-17-7-3-2-4-8-17/h2-4,7-8,11-14,20H,15-16,26H2,1H3,(H,27,32)(H,28,31)(H2,29,30,33,34)/t20-,25?/m0/s1
    MOLECULAR FORMULA
    C25H23N5O4
    CROSS REFERENCES
    1528275 logo

    canSAR1528275

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 457.18
    AlogP -0.14
    HBond donors 6
    HBond acceptors 9
    Atoms 57
    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 canSAR1528275.