177010 logo
canSAR177010
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    Cc1ccccc1NC(=O)NCCCC[C@H](NC(=O)C(Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N(C)CC(=O)N(C)C(Cc1ccccc1)C(N)=O
    InChI
    InChI=1S/C43H56N8O7/c1-28-16-10-12-20-32(28)48-41(56)45-23-15-14-22-34(40(55)50(5)27-37(52)51(6)36(38(44)53)24-29-17-8-7-9-18-29)47-39(54)35(49-42(57)58-43(2,3)4)25-30-26-46-33-21-13-11-19-31(30)33/h7-13,16-21,26,34-36,46H,14-15,22-25,27H2,1-6H3,(H2,44,53)(H,47,54)(H,49,57)(H2,45,48,56)/t34-,35?,36?/m0/s1
    MOLECULAR FORMULA
    C43H56N8O7
    CROSS REFERENCES
    177010 logo

    canSAR177010

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 796.43
    AlogP 4.40
    HBond donors 7
    HBond acceptors 15
    Atoms 114
    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 canSAR177010.