canSAR1417460
FEATURES
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NAMES
    SMILES
    N=C(N)NCCC[C@H](N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O
    InChI
    InChI=1S/C48H95N25O11/c49-18-4-1-12-29(70-40(79)30(15-8-22-62-46(55)56)69-37(76)27-66-38(77)28(52)11-7-21-61-45(53)54)39(78)67-25-35(74)65-26-36(75)68-31(16-9-23-63-47(57)58)41(80)72-33(17-10-24-64-48(59)60)42(81)71-32(13-2-5-19-50)43(82)73-34(44(83)84)14-3-6-20-51/h28-34H,1-27,49-52H2,(H,65,74)(H,66,77)(H,67,78)(H,68,75)(H,69,76)(H,70,79)(H,71,81)(H,72,80)(H,73,82)(H,83,84)(H4,53,54,61)(H4,55,56,62)(H4,57,58,63)(H4,59,60,64)/t28-,29-,30-,31-,32-,33-,34-/m0/s1
    MOLECULAR FORMULA
    C48H95N25O11
    CROSS REFERENCES
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    canSAR1417460
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1197.76
    AlogP-8.90
    HBond donors34
    HBond acceptors36
    Atoms179
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1417460.