canSAR1846267
FEATURES
Loading...
NAMES
    SMILES
    NCCCC[C@H](N)CN(CC(=O)N[C@@H](Cc1ccccc1)CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](Cc1ccccc1)CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](Cc1ccccc1)CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](Cc1ccccc1)CN(CC(N)=O)S(=O)(=O)Cc1ccccc1)S(=O)(=O)CCN)S(=O)(=O)Cc1ccccc1)S(=O)(=O)Cc1ccccc1)S(=O)(=O)Cc1ccccc1)S(=O)(=O)CCN)S(=O)(=O)Cc1ccccc1)S(=O)(=O)Cc1ccccc1
    InChI
    InChI=1S/C122H173N23O24S8/c123-63-35-31-59-107(129)75-138(172(158,159)91-101-47-19-5-20-48-101)84-119(150)135-112(72-98-41-13-2-14-42-98)80-143(175(164,165)94-104-53-25-8-26-54-104)87-116(147)132-109(61-33-37-65-125)77-141(171(156,157)70-68-128)86-121(152)136-113(73-99-43-15-3-16-44-99)81-144(176(166,167)95-105-55-27-9-28-56-105)89-118(149)133-110(62-34-38-66-126)78-142(174(162,163)93-103-51-23-7-24-52-103)90-122(153)137-114(74-100-45-17-4-18-46-100)82-145(177(168,169)96-106-57-29-10-30-58-106)88-117(148)131-108(60-32-36-64-124)76-140(170(154,155)69-67-127)85-120(151)134-111(71-97-39-11-1-12-40-97)79-139(83-115(130)146)173(160,161)92-102-49-21-6-22-50-102/h1-30,39-58,107-114H,31-38,59-96,123-129H2,(H2,130,146)(H,131,148)(H,132,147)(H,133,149)(H,134,151)(H,135,150)(H,136,152)(H,137,153)/t107-,108-,109-,110-,111-,112-,113-,114-/m0/s1
    MOLECULAR FORMULA
    C122H173N23O24S8
    CROSS REFERENCES
    Loading...
    canSAR1846267
    Compound Synopsis
    OVERVIEW
    PROPERTIES
    Molecular weight2600.08
    AlogP2.85
    HBond donors23
    HBond acceptors47
    Atoms350
    Contains toxicophoreNo
    Contains PAINSNo
    Commercially availableUnknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1846267.