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canSAR1125703
FEATURES
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NAMES
    SMILES
    COC(=O)[C@](C)(Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CC(N)=O)NC(C)=O)C(C)C)C(C)C
    InChI
    InChI=1S/C53H76N14O12/c1-29(2)42(64-44(71)36(15-11-21-58-52(55)56)61-45(72)38(25-41(54)70)60-31(5)68)48(75)62-37(23-32-17-19-35(69)20-18-32)46(73)65-43(30(3)4)49(76)63-39(24-34-27-57-28-59-34)50(77)67-22-12-16-40(67)47(74)66-53(6,51(78)79-7)26-33-13-9-8-10-14-33/h8-10,13-14,17-20,27-30,36-40,42-43,69H,11-12,15-16,21-26H2,1-7H3,(H2,54,70)(H,57,59)(H,60,68)(H,61,72)(H,62,75)(H,63,76)(H,64,71)(H,65,73)(H,66,74)(H4,55,56,58)/t36-,37-,38-,39-,40-,42-,43-,53-/m0/s1
    MOLECULAR FORMULA
    C53H76N14O12
    CROSS REFERENCES
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    canSAR1125703

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1100.58
    AlogP -1.65
    HBond donors 15
    HBond acceptors 26
    Atoms 155
    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 canSAR1125703.