400076 logo
canSAR400076
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCOC(=O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)C1(c2ccccc2)CC1)C(C)C
    InChI
    InChI=1S/C27H40N2O5/c1-4-34-25(32)23(30)21(17-19-11-7-5-8-12-19)28-24(31)22(18(2)3)29-26(33)27(15-16-27)20-13-9-6-10-14-20/h6,9-10,13-14,18-19,21-23,30H,4-5,7-8,11-12,15-17H2,1-3H3,(H,28,31)(H,29,33)/t21-,22-,23+/m0/s1
    MOLECULAR FORMULA
    C27H40N2O5
    CROSS REFERENCES
    400076 logo

    canSAR400076

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 472.29
    AlogP 3.24
    HBond donors 3
    HBond acceptors 7
    Atoms 74
    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 canSAR400076.