Natural Product: NPC194769

Natural Product ID:  NPC194769
Common Name:   3Beta,5Alpha,7Beta,8Alpha,9Alpha,15Beta-Hexaacetoxy-2Alpha-Benzoyloxyjatropha-6(17),11E-Dien-14-One
IUPAC Name:   [(1R,2R,3aR,5S,6E,9S,10S,11S,13R,13aS)-1,3a,9,10,11,13-hexaacetyloxy-2,5,8,8-tetramethyl-12-methylidene-4-oxo-1,3,5,9,10,11,13,13a-octahydrocyclopenta[12]annulen-2-yl] benzoate
Synonyms:  
Molecular Formula:   C39H48O15
Standard InCHIKey:  FNACLYUOYPRWGC-AISMXQSVSA-N
Standard InCHI:  InChI=1S/C39H48O15/c1-20-17-18-37(9,10)35(52-26(7)44)32(50-24(5)42)31(49-23(4)41)21(2)30(48-22(3)40)29-34(51-25(6)43)38(11,19-39(29,33(20)46)53-27(8)45)54-36(47)28-15-13-12-14-16-28/h12-18,20,29-32,34-35H,2,19H2,1,3-11H3/b18-17+/t20-,29-,30-,31-,32+,34+,35+,38+,39+/m0/s1
Canonical SMILES:  CC(=O)O[C@H]1C(=C)[C@H](OC(=O)C)[C@H]2[C@@H](OC(=O)C)[C@](C[C@]2(OC(=O)C)C(=O)[C@H](/C=C/C([C@@H]([C@@H]1OC(=O)C)OC(=O)C)(C)C)C)(C)OC(=O)c1ccccc1
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO9973 Euphorbia turczaninowii Species Euphorbiaceae Eukaryota PMID[11520228]
NPO68 Paracynoglossum imeretinum Species Boraginaceae Eukaryota UNPD*
NPO10244 Aglaia elliptifolia Species Meliaceae Eukaryota UNPD*
NPO9716 Encephalartos villosus Species Zamiaceae Eukaryota UNPD*
NPO2595 Aspergillus terreus Species Aspergillaceae Eukaryota UNPD*
NPO8236 Phakellia aruensis Species Bubaridae Eukaryota UNPD*
NPO5818 Cordyceps confragosa Species Cordycipitaceae Eukaryota UNPD*
NPO7624 Callitris tasmanica Species Cupressaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT32 Organism Mus musculus Mus musculus ID50 > 100 ug 11520228
NPT319 Cell Line B16 Mus musculus IC50 > 5 ug/ml 11520228

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC194769 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
1.0 High Similarity NPC285221
0.9922 High Similarity NPC475262
0.9922 High Similarity NPC290833
0.9922 High Similarity NPC265459
0.9846 High Similarity NPC272523
0.9846 High Similarity NPC325805
0.9844 High Similarity NPC472250
0.9771 High Similarity NPC475660
0.9769 High Similarity NPC86772
0.9615 High Similarity NPC270364
0.9615 High Similarity NPC79699
0.9552 High Similarity NPC477096
0.9552 High Similarity NPC45307
0.9552 High Similarity NPC477094
0.9549 High Similarity NPC473497
0.9407 High Similarity NPC82467
0.9403 High Similarity NPC475413
0.9403 High Similarity NPC474303
0.9398 High Similarity NPC276652
0.9343 High Similarity NPC477095
0.9328 High Similarity NPC251294
0.9275 High Similarity NPC205389
0.9259 High Similarity NPC473654
0.9231 High Similarity NPC475508
0.9231 High Similarity NPC42234
0.9203 High Similarity NPC170668
0.9173 High Similarity NPC472247
0.9143 High Similarity NPC232583
0.9143 High Similarity NPC477099
0.9143 High Similarity NPC477101
0.9143 High Similarity NPC25484
0.9143 High Similarity NPC477097
0.9124 High Similarity NPC153214
0.9118 High Similarity NPC187566
0.9098 High Similarity NPC153617
0.9091 High Similarity NPC477360
0.9091 High Similarity NPC233860
0.9084 High Similarity NPC272946
0.903 High Similarity NPC149401
0.903 High Similarity NPC279637
0.9023 High Similarity NPC472248
0.8963 High Similarity NPC477358
0.8963 High Similarity NPC202729
0.8955 High Similarity NPC311492
0.8955 High Similarity NPC298547
0.8955 High Similarity NPC477368
0.8955 High Similarity NPC134937
0.8955 High Similarity NPC324898
0.8955 High Similarity NPC28836
0.8951 High Similarity NPC477100
0.8951 High Similarity NPC477098
0.8947 High Similarity NPC239358
0.8939 High Similarity NPC122504
0.8939 High Similarity NPC3450
0.8939 High Similarity NPC475452
0.8939 High Similarity NPC475671
0.8897 High Similarity NPC27721
0.8889 High Similarity NPC200154
0.8889 High Similarity NPC477367
0.8889 High Similarity NPC232888
0.8881 High Similarity NPC477364
0.8841 High Similarity NPC242355
0.8832 High Similarity NPC121268
0.8832 High Similarity NPC53361
0.8832 High Similarity NPC473301
0.8815 High Similarity NPC477359
0.8806 High Similarity NPC233692
0.8777 High Similarity NPC475135
0.8769 High Similarity NPC8990
0.8759 High Similarity NPC327511
0.8759 High Similarity NPC205305
0.8741 High Similarity NPC125033
0.8702 High Similarity NPC477369
0.8571 High Similarity NPC70344
0.8451 Intermediate Similarity NPC191387
0.8451 Intermediate Similarity NPC131966
0.8411 Intermediate Similarity NPC55744
0.837 Intermediate Similarity NPC477370
0.8358 Intermediate Similarity NPC477366
0.8358 Intermediate Similarity NPC477363
0.8346 Intermediate Similarity NPC477362
0.8333 Intermediate Similarity NPC471107
0.8333 Intermediate Similarity NPC471100
0.8322 Intermediate Similarity NPC95449
0.8309 Intermediate Similarity NPC37968
0.8296 Intermediate Similarity NPC477365
0.8296 Intermediate Similarity NPC477357
0.8273 Intermediate Similarity NPC471911
0.8273 Intermediate Similarity NPC4242
0.8255 Intermediate Similarity NPC469456
0.8231 Intermediate Similarity NPC254558
0.8176 Intermediate Similarity NPC51602
0.8162 Intermediate Similarity NPC472706
0.8151 Intermediate Similarity NPC475552
0.8138 Intermediate Similarity NPC470231
0.8129 Intermediate Similarity NPC475569
0.8129 Intermediate Similarity NPC472394
0.8125 Intermediate Similarity NPC182869
0.8121 Intermediate Similarity NPC469647
0.8121 Intermediate Similarity NPC138641
0.8121 Intermediate Similarity NPC22571
0.8121 Intermediate Similarity NPC469648
0.8121 Intermediate Similarity NPC283875
0.8112 Intermediate Similarity NPC87934
0.8112 Intermediate Similarity NPC162613
0.8102 Intermediate Similarity NPC472707
0.8088 Intermediate Similarity NPC476599
0.8082 Intermediate Similarity NPC25043
0.8082 Intermediate Similarity NPC127857
0.8082 Intermediate Similarity NPC134131
0.8074 Intermediate Similarity NPC472704
0.8056 Intermediate Similarity NPC266374
0.8054 Intermediate Similarity NPC472398
0.8054 Intermediate Similarity NPC471103
0.8045 Intermediate Similarity NPC473243
0.8042 Intermediate Similarity NPC9905
0.8041 Intermediate Similarity NPC473403
0.8027 Intermediate Similarity NPC312393
0.8013 Intermediate Similarity NPC473611
0.8013 Intermediate Similarity NPC473670
0.8013 Intermediate Similarity NPC21410
0.8013 Intermediate Similarity NPC282239
0.8 Intermediate Similarity NPC233581
0.8 Intermediate Similarity NPC192658
0.8 Intermediate Similarity NPC472546
0.8 Intermediate Similarity NPC183540
0.8 Intermediate Similarity NPC145649
0.8 Intermediate Similarity NPC472703
0.7987 Intermediate Similarity NPC7095
0.7987 Intermediate Similarity NPC112216
0.7986 Intermediate Similarity NPC473440
0.7973 Intermediate Similarity NPC327031
0.7961 Intermediate Similarity NPC106895
0.7961 Intermediate Similarity NPC11410
0.7961 Intermediate Similarity NPC217091
0.7958 Intermediate Similarity NPC472577
0.7958 Intermediate Similarity NPC291638
0.7958 Intermediate Similarity NPC195647
0.7958 Intermediate Similarity NPC66761
0.7958 Intermediate Similarity NPC17877
0.7933 Intermediate Similarity NPC96308
0.7933 Intermediate Similarity NPC306799
0.7933 Intermediate Similarity NPC161955
0.7933 Intermediate Similarity NPC101043
0.7919 Intermediate Similarity NPC250046
0.7919 Intermediate Similarity NPC76103
0.7919 Intermediate Similarity NPC60509
0.7919 Intermediate Similarity NPC81698
0.7917 Intermediate Similarity NPC170718
0.7908 Intermediate Similarity NPC472393
0.7905 Intermediate Similarity NPC478263
0.7902 Intermediate Similarity NPC217673
0.7902 Intermediate Similarity NPC52523
0.7895 Intermediate Similarity NPC251139
0.7895 Intermediate Similarity NPC473632
0.7895 Intermediate Similarity NPC132599
0.7895 Intermediate Similarity NPC469730
0.7891 Intermediate Similarity NPC34943
0.7887 Intermediate Similarity NPC474608
0.7883 Intermediate Similarity NPC246166
0.7877 Intermediate Similarity NPC63737
0.7877 Intermediate Similarity NPC51181
0.7872 Intermediate Similarity NPC469499
0.7871 Intermediate Similarity NPC329997
0.7867 Intermediate Similarity NPC165260
0.7867 Intermediate Similarity NPC198455
0.7867 Intermediate Similarity NPC470245
0.7867 Intermediate Similarity NPC473214
0.7867 Intermediate Similarity NPC161239
0.7862 Intermediate Similarity NPC477904
0.7862 Intermediate Similarity NPC200592
0.7862 Intermediate Similarity NPC43241
0.7862 Intermediate Similarity NPC473081
0.7862 Intermediate Similarity NPC183270
0.7862 Intermediate Similarity NPC48017
0.7862 Intermediate Similarity NPC476094
0.7862 Intermediate Similarity NPC473085
0.7862 Intermediate Similarity NPC184747
0.7862 Intermediate Similarity NPC4341
0.7862 Intermediate Similarity NPC147880
0.7862 Intermediate Similarity NPC473613
0.7862 Intermediate Similarity NPC473758
0.7862 Intermediate Similarity NPC473060
0.7862 Intermediate Similarity NPC473112
0.7862 Intermediate Similarity NPC473109
0.7862 Intermediate Similarity NPC211137
0.7857 Intermediate Similarity NPC82712
0.7857 Intermediate Similarity NPC471102
0.7857 Intermediate Similarity NPC147561
0.7848 Intermediate Similarity NPC161151
0.7847 Intermediate Similarity NPC184109
0.7847 Intermediate Similarity NPC475373
0.7838 Intermediate Similarity NPC125882
0.7838 Intermediate Similarity NPC478264
0.7838 Intermediate Similarity NPC471162
0.7832 Intermediate Similarity NPC477893
0.7829 Intermediate Similarity NPC472022
0.7829 Intermediate Similarity NPC242262
0.7829 Intermediate Similarity NPC158333
0.7829 Intermediate Similarity NPC472030

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC194769 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
0.8082 Intermediate Similarity NPD7236 Approved
0.7933 Intermediate Similarity NPD7239 Suspended
0.7925 Intermediate Similarity NPD7799 Discontinued
0.7692 Intermediate Similarity NPD7966 Clinical (unspecified phase)
0.7557 Intermediate Similarity NPD2181 Clinical (unspecified phase)
0.7518 Intermediate Similarity NPD6007 Clinical (unspecified phase)
0.7481 Intermediate Similarity NPD2067 Discontinued
0.7468 Intermediate Similarity NPD7058 Phase 2
0.7468 Intermediate Similarity NPD7057 Phase 3
0.7405 Intermediate Similarity NPD2182 Approved
0.7333 Intermediate Similarity NPD690 Clinical (unspecified phase)
0.7214 Intermediate Similarity NPD7457 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7961 Discontinued
0.7121 Intermediate Similarity NPD6685 Approved
0.7101 Intermediate Similarity NPD8368 Discontinued
0.7101 Intermediate Similarity NPD7685 Pre-registration
0.7099 Intermediate Similarity NPD164 Approved
0.7076 Intermediate Similarity NPD8407 Phase 2
0.7021 Intermediate Similarity NPD3412 Clinical (unspecified phase)
0.7013 Intermediate Similarity NPD4628 Phase 3
0.7007 Intermediate Similarity NPD5952 Clinical (unspecified phase)
0.6957 Remote Similarity NPD2629 Approved
0.6951 Remote Similarity NPD5537 Clinical (unspecified phase)
0.6937 Remote Similarity NPD6599 Discontinued
0.6934 Remote Similarity NPD6858 Approved
0.6934 Remote Similarity NPD7094 Approved
0.6923 Remote Similarity NPD6287 Discontinued
0.6918 Remote Similarity NPD5740 Clinical (unspecified phase)
0.6918 Remote Similarity NPD6085 Phase 2
0.6906 Remote Similarity NPD4198 Discontinued
0.6901 Remote Similarity NPD6764 Approved
0.6901 Remote Similarity NPD6765 Approved
0.6897 Remote Similarity NPD8424 Clinical (unspecified phase)
0.6897 Remote Similarity NPD8434 Phase 2
0.6894 Remote Similarity NPD5765 Approved
0.6879 Remote Similarity NPD7741 Discontinued
0.6861 Remote Similarity NPD1609 Clinical (unspecified phase)
0.6861 Remote Similarity NPD6912 Phase 3
0.6818 Remote Similarity NPD6002 Phase 3
0.6818 Remote Similarity NPD6005 Phase 3
0.6818 Remote Similarity NPD8435 Approved
0.6818 Remote Similarity NPD6006 Clinical (unspecified phase)
0.6818 Remote Similarity NPD6004 Phase 3
0.6818 Remote Similarity NPD6003 Clinical (unspecified phase)
0.681 Remote Similarity NPD7096 Clinical (unspecified phase)
0.6794 Remote Similarity NPD1238 Approved
0.6788 Remote Similarity NPD7075 Discontinued
0.6772 Remote Similarity NPD6799 Approved
0.6767 Remote Similarity NPD5738 Clinical (unspecified phase)
0.6761 Remote Similarity NPD9545 Approved
0.6752 Remote Similarity NPD6190 Approved
0.6752 Remote Similarity NPD3887 Approved
0.6743 Remote Similarity NPD6785 Approved
0.6743 Remote Similarity NPD6784 Approved
0.6743 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6725 Remote Similarity NPD8470 Clinical (unspecified phase)
0.6723 Remote Similarity NPD8361 Approved
0.6723 Remote Similarity NPD8360 Approved
0.6711 Remote Similarity NPD6355 Discontinued
0.6707 Remote Similarity NPD5761 Phase 2
0.6707 Remote Similarity NPD5760 Phase 2
0.6667 Remote Similarity NPD5667 Approved
0.6667 Remote Similarity NPD6653 Approved
0.6646 Remote Similarity NPD6801 Discontinued
0.6645 Remote Similarity NPD7137 Phase 2
0.6642 Remote Similarity NPD6831 Clinical (unspecified phase)
0.6642 Remote Similarity NPD6647 Phase 2
0.6625 Remote Similarity NPD8389 Clinical (unspecified phase)
0.6623 Remote Similarity NPD3764 Approved
0.661 Remote Similarity NPD8150 Discontinued
0.6603 Remote Similarity NPD5763 Approved
0.6603 Remote Similarity NPD5762 Approved
0.6603 Remote Similarity NPD7702 Clinical (unspecified phase)
0.6601 Remote Similarity NPD230 Phase 1
0.6593 Remote Similarity NPD8485 Approved
0.6584 Remote Similarity NPD6273 Approved
0.6581 Remote Similarity NPD7305 Phase 1
0.6577 Remote Similarity NPD5647 Approved
0.6568 Remote Similarity NPD8127 Discontinued
0.6566 Remote Similarity NPD5402 Approved
0.6566 Remote Similarity NPD3817 Phase 2
0.6556 Remote Similarity NPD7008 Discontinued
0.6554 Remote Similarity NPD1876 Approved
0.6543 Remote Similarity NPD5403 Approved
0.6543 Remote Similarity NPD6980 Clinical (unspecified phase)
0.6531 Remote Similarity NPD6637 Approved
0.6531 Remote Similarity NPD3972 Approved
0.6522 Remote Similarity NPD5401 Approved
0.651 Remote Similarity NPD6362 Approved
0.6506 Remote Similarity NPD7819 Suspended
0.6497 Remote Similarity NPD2353 Approved
0.6497 Remote Similarity NPD2355 Clinical (unspecified phase)
0.649 Remote Similarity NPD6832 Phase 2
0.6486 Remote Similarity NPD8486 Clinical (unspecified phase)
0.6471 Remote Similarity NPD7713 Phase 3
0.6471 Remote Similarity NPD1237 Approved
0.6464 Remote Similarity NPD7879 Clinical (unspecified phase)
0.6463 Remote Similarity NPD7458 Discontinued
0.6463 Remote Similarity NPD4806 Approved
0.6463 Remote Similarity NPD4807 Approved
0.6438 Remote Similarity NPD17 Approved
0.6438 Remote Similarity NPD5306 Approved
0.6438 Remote Similarity NPD5305 Approved
0.6433 Remote Similarity NPD2796 Approved
0.6424 Remote Similarity NPD3661 Approved
0.6424 Remote Similarity NPD3663 Approved
0.6424 Remote Similarity NPD3664 Approved
0.6424 Remote Similarity NPD3662 Phase 3
0.642 Remote Similarity NPD7004 Clinical (unspecified phase)
0.6418 Remote Similarity NPD7798 Approved
0.6415 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6412 Remote Similarity NPD5494 Approved
0.641 Remote Similarity NPD2567 Approved
0.641 Remote Similarity NPD2569 Approved
0.6397 Remote Similarity NPD1931 Clinical (unspecified phase)
0.6397 Remote Similarity NPD1929 Approved
0.6397 Remote Similarity NPD1930 Approved
0.6392 Remote Similarity NPD2343 Clinical (unspecified phase)
0.6386 Remote Similarity NPD6385 Approved
0.6386 Remote Similarity NPD6386 Approved
0.6383 Remote Similarity NPD7497 Discontinued
0.6383 Remote Similarity NPD969 Suspended
0.6382 Remote Similarity NPD7055 Discontinued
0.6369 Remote Similarity NPD5353 Approved
0.6364 Remote Similarity NPD8032 Phase 2
0.6364 Remote Similarity NPD4766 Approved
0.6364 Remote Similarity NPD6663 Approved
0.6364 Remote Similarity NPD5951 Approved
0.6357 Remote Similarity NPD4234 Approved
0.6357 Remote Similarity NPD4233 Approved
0.6353 Remote Similarity NPD919 Approved
0.6343 Remote Similarity NPD9495 Approved
0.6343 Remote Similarity NPD7804 Clinical (unspecified phase)
0.6341 Remote Similarity NPD920 Approved
0.6335 Remote Similarity NPD2354 Approved
0.6331 Remote Similarity NPD4868 Clinical (unspecified phase)
0.6331 Remote Similarity NPD3882 Suspended
0.6325 Remote Similarity NPD4380 Phase 2
0.6319 Remote Similarity NPD2533 Approved
0.6319 Remote Similarity NPD2534 Approved
0.6319 Remote Similarity NPD2532 Approved
0.6316 Remote Similarity NPD5736 Approved
0.6312 Remote Similarity NPD4141 Clinical (unspecified phase)
0.6309 Remote Similarity NPD1608 Approved
0.6304 Remote Similarity NPD5048 Discontinued
0.6301 Remote Similarity NPD7009 Phase 2
0.6301 Remote Similarity NPD7184 Clinical (unspecified phase)
0.6296 Remote Similarity NPD2066 Phase 3
0.6296 Remote Similarity NPD6652 Clinical (unspecified phase)
0.6289 Remote Similarity NPD8462 Phase 1
0.6288 Remote Similarity NPD1202 Approved
0.6284 Remote Similarity NPD4135 Approved
0.6284 Remote Similarity NPD4106 Approved
0.6284 Remote Similarity NPD4136 Approved
0.6273 Remote Similarity NPD2575 Approved
0.6273 Remote Similarity NPD6398 Clinical (unspecified phase)
0.6273 Remote Similarity NPD8166 Discontinued
0.6272 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6271 Remote Similarity NPD7993 Clinical (unspecified phase)
0.6268 Remote Similarity NPD8297 Approved
0.6266 Remote Similarity NPD2799 Discontinued
0.6266 Remote Similarity NPD7033 Discontinued
0.6266 Remote Similarity NPD3748 Approved
0.6265 Remote Similarity NPD6591 Clinical (unspecified phase)
0.6264 Remote Similarity NPD7784 Clinical (unspecified phase)
0.6259 Remote Similarity NPD7899 Clinical (unspecified phase)
0.6258 Remote Similarity NPD6233 Phase 2
0.625 Remote Similarity NPD9259 Approved
0.625 Remote Similarity NPD9257 Approved
0.6241 Remote Similarity NPD1693 Approved
0.6234 Remote Similarity NPD7095 Approved
0.6234 Remote Similarity NPD6039 Approved
0.6233 Remote Similarity NPD7610 Discontinued
0.6232 Remote Similarity NPD5909 Discontinued
0.6229 Remote Similarity NPD7473 Discontinued
0.6226 Remote Similarity NPD2438 Suspended
0.6225 Remote Similarity NPD2198 Approved
0.6225 Remote Similarity NPD2199 Approved
0.622 Remote Similarity NPD642 Clinical (unspecified phase)
0.622 Remote Similarity NPD4378 Clinical (unspecified phase)
0.6216 Remote Similarity NPD5125 Phase 3
0.6216 Remote Similarity NPD5126 Approved
0.6209 Remote Similarity NPD7084 Phase 3
0.6209 Remote Similarity NPD5204 Approved
0.6207 Remote Similarity NPD3926 Phase 2
0.6207 Remote Similarity NPD5242 Approved
0.6199 Remote Similarity NPD4381 Clinical (unspecified phase)
0.6194 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6194 Remote Similarity NPD6798 Discontinued
0.6194 Remote Similarity NPD1989 Approved
0.6194 Remote Similarity NPD2313 Discontinued
0.6193 Remote Similarity NPD7893 Clinical (unspecified phase)
0.619 Remote Similarity NPD6319 Approved
0.619 Remote Similarity NPD7411 Suspended
0.6188 Remote Similarity NPD1471 Phase 3
0.6185 Remote Similarity NPD1247 Approved
0.6184 Remote Similarity NPD3266 Approved
0.6184 Remote Similarity NPD3267 Approved
0.6183 Remote Similarity NPD3672 Approved
0.6183 Remote Similarity NPD3673 Approved

Structure

External Identifiers

PubChem CID   10865555
ChEMBL   CHEMBL504131
ZINC  

Physicochemical Properties

Molecular Weight:  756.30
ALogP:  0.7206
MLogP:  4.1
XLogP:  4.974
# Rotatable Bonds:  25
Polar Surface Area:  201.17
# H-Bond Aceptor:  15
# H-Bond Donor:  0
# Rings:  3
# Heavy Atoms:  54

Download Data

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Biological Activities  
Similar NPs/Drugs