canSAR1531202
FEATURES
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NAMES
    SMILES
    CC(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H]1CCCNC(=O)CC[C@@H](C(N)=O)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc2ccccc2F)NC(=O)[C@H](Cc2c[nH]cn2)NC1=O
    InChI
    InChI=1S/C50H69FN18O9/c1-27(70)63-35(13-7-19-59-49(53)54)43(73)65-36-14-6-18-58-41(71)17-16-34(42(52)72)64-46(76)39(22-29-24-61-33-12-5-3-10-31(29)33)67-44(74)37(15-8-20-60-50(55)56)66-47(77)38(21-28-9-2-4-11-32(28)51)68-48(78)40(69-45(36)75)23-30-25-57-26-62-30/h2-5,9-12,24-26,34-40,61H,6-8,13-23H2,1H3,(H2,52,72)(H,57,62)(H,58,71)(H,63,70)(H,64,76)(H,65,73)(H,66,77)(H,67,74)(H,68,78)(H,69,75)(H4,53,54,59)(H4,55,56,60)/t34-,35+,36-,37-,38+,39-,40-/m0/s1
    MOLECULAR FORMULA
    C50H69FN18O9
    CROSS REFERENCES
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    canSAR1531202
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight1084.55
    AlogP-2.83
    HBond donors20
    HBond acceptors27
    Atoms147
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1531202.