46242 logo
canSAR46242
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CCCCNC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCCC)N1Cc2ccccc2C[C@H](NC(C)=O)C1=O)C(C)C
    InChI
    InChI=1S/C37H60N4O5/c1-6-8-19-33(41-24-29-18-14-13-17-28(29)22-32(37(41)46)39-26(5)42)36(45)40-31(21-27-15-11-10-12-16-27)34(43)23-30(25(3)4)35(44)38-20-9-7-2/h13-14,17-18,25,27,30-34,43H,6-12,15-16,19-24H2,1-5H3,(H,38,44)(H,39,42)(H,40,45)/t30-,31-,32-,33-,34-/m0/s1
    MOLECULAR FORMULA
    C37H60N4O5
    CROSS REFERENCES
    46242 logo

    canSAR46242

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 640.46
    AlogP 5.03
    HBond donors 4
    HBond acceptors 9
    Atoms 106
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR46242.