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canSAR462278
FEATURES
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NAMES
    SMILES
    CC[C@H](C)[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](N)CC(=O)N(C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O
    InChI
    InChI=1S/C56H84N14O11/c1-9-34(8)47(53(78)65-42(27-37-29-60-30-62-37)54(79)69-24-14-18-44(69)51(76)66-43(55(80)81)26-35-15-11-10-12-16-35)68-50(75)41(25-36-19-21-38(71)22-20-36)64-52(77)46(31(2)3)67-49(74)40(17-13-23-61-56(58)59)63-48(73)39(57)28-45(72)70(32(4)5)33(6)7/h10-12,15-16,19-22,29-34,39-44,46-47,71H,9,13-14,17-18,23-28,57H2,1-8H3,(H,60,62)(H,63,73)(H,64,77)(H,65,78)(H,66,76)(H,67,74)(H,68,75)(H,80,81)(H4,58,59,61)/t34-,39-,40-,41-,42-,43-,44+,46-,47-/m0/s1
    MOLECULAR FORMULA
    C56H84N14O11
    CROSS REFERENCES
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    canSAR462278

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 1128.64
    AlogP 0.25
    HBond donors 15
    HBond acceptors 25
    Atoms 165
    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 canSAR462278.