394348 logo
canSAR394348
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    COc1cc(N(C)CCCNC(=O)N[C@@H](Cc2cnc[nH]2)C(=O)O)c2nc(C(C)(C)C)ccc2c1
    InChI
    InChI=1S/C25H34N6O4/c1-25(2,3)21-8-7-16-11-18(35-5)13-20(22(16)30-21)31(4)10-6-9-27-24(34)29-19(23(32)33)12-17-14-26-15-28-17/h7-8,11,13-15,19H,6,9-10,12H2,1-5H3,(H,26,28)(H,32,33)(H2,27,29,34)/t19-/m0/s1
    MOLECULAR FORMULA
    C25H34N6O4
    CROSS REFERENCES
    394348 logo

    canSAR394348

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 482.26
    AlogP 3.09
    HBond donors 4
    HBond acceptors 10
    Atoms 69
    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 canSAR394348.