1144161 logo
canSAR1144161
FEATURES
Loading...
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
avatar
NAMES
    SMILES
    CC(C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)OC(C)(C)C)C(=O)NC(CCC(=O)O)P(=O)(Oc1ccccc1)Oc1ccccc1
    InChI
    InChI=1S/C30H40N3O11P/c1-19(2)26(33-27(38)22(18-25(36)37)31-29(40)42-30(3,4)5)28(39)32-23(16-17-24(34)35)45(41,43-20-12-8-6-9-13-20)44-21-14-10-7-11-15-21/h6-15,19,22-23,26H,16-18H2,1-5H3,(H,31,40)(H,32,39)(H,33,38)(H,34,35)(H,36,37)/t22-,23?,26-/m0/s1
    MOLECULAR FORMULA
    C30H40N3O11P
    CROSS REFERENCES
    1144161 logo

    canSAR1144161

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 649.24
    AlogP 4.15
    HBond donors 5
    HBond acceptors 14
    Atoms 85
    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 canSAR1144161.