canSAR739434
FEATURES
Loading...
NAMES
    SMILES
    CCC[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CN(C)C(=O)CCC(=O)O)C(C)C)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)NCC)[C@@H](C)CC
    InChI
    InChI=1S/C48H85N13O13/c1-11-17-30(41(68)57-38(27(7)12-2)44(71)55-31(18-15-22-52-48(49)50)47(74)61-23-16-19-32(61)42(69)51-14-4)54-46(73)40(29(9)62)59-45(72)39(28(8)13-3)58-43(70)37(26(5)6)56-33(63)24-53-34(64)25-60(10)35(65)20-21-36(66)67/h26-32,37-40,62H,11-25H2,1-10H3,(H,51,69)(H,53,64)(H,54,73)(H,55,71)(H,56,63)(H,57,68)(H,58,70)(H,59,72)(H,66,67)(H4,49,50,52)/t27-,28-,29+,30-,31-,32-,37-,38-,39+,40-/m0/s1
    MOLECULAR FORMULA
    C48H85N13O13
    CROSS REFERENCES
    Loading...
    canSAR739434
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1051.64
    AlogP-2.56
    HBond donors14
    HBond acceptors26
    Atoms159
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR739434.