Natural Product: NPC474407

Natural Product ID:  NPC474407
Common Name:   (2R)-Dimethyl 2-((R,6E,10E)-13-(Furan-3-Yl)-2,6,10-Trimethyltrideca-6,10-Dienyl)-2,3-Dihydroxy-3-Methylsuccinate
IUPAC Name:   dimethyl (2R)-2-[(2R,6E,10E)-13-(furan-3-yl)-2,6,10-trimethyltrideca-6,10-dienyl]-2,3-dihydroxy-3-methylbutanedioate
Synonyms:  
Molecular Formula:   C27H42O7
Standard InCHIKey:  XNPSWLTVIZNGCO-NXJGCRIQSA-N
Standard InCHI:  InChI=1S/C27H42O7/c1-20(10-7-11-21(2)13-9-15-23-16-17-34-19-23)12-8-14-22(3)18-27(31,25(29)33-6)26(4,30)24(28)32-5/h10,13,16-17,19,22,30-31H,7-9,11-12,14-15,18H2,1-6H3/b20-10+,21-13+/t22-,26?,27+/m1/s1
Canonical SMILES:  COC(=O)[C@](C(C(=O)OC)(O)C)(C[C@@H](CCC/C(=C/CC/C(=C/CCc1cocc1)/C)/C)C)O
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
NPO33064 sarcotragus sp. Species Irciniidae Eukaryota PMID[18341287]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 100 ug/ml 7562925
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 100 ug/ml 19902967
NPT19 Organism Escherichia coli Escherichia coli MIC > 100 ug/ml 21376582
NPT766 Organism Proteus vulgaris Proteus vulgaris MIC > 100 ug/ml 19114678
NPT566 Organism Salmonella typhimurium Salmonella enterica subsp. enterica serovar Typhimurium MIC > 100 ug/ml 19846302
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 100 ug/ml 16989518
NPT1087 Individual Protein Isocitrate lyase Candida albicans IC50 > 200 ug/ml 16643028
NPT111 Cell Line K562 Homo sapiens LC50 = 20 ug/ml 19654408
NPT729 Organism Micrococcus luteus Micrococcus luteus MIC = 100 ug/ml 19654408
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC > 100 ug/ml 11909717
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 100 ug/ml 22194678

  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 NPC474407 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 NPC474426
1.0 High Similarity NPC474425
0.9062 High Similarity NPC474830
0.9062 High Similarity NPC476016
0.8992 High Similarity NPC474438
0.8992 High Similarity NPC474279
0.8906 High Similarity NPC474829
0.8837 High Similarity NPC329922
0.8837 High Similarity NPC329694
0.8837 High Similarity NPC474260
0.8837 High Similarity NPC81912
0.876 High Similarity NPC71274
0.876 High Similarity NPC75557
0.872 High Similarity NPC208906
0.872 High Similarity NPC144745
0.8676 High Similarity NPC473268
0.8647 High Similarity NPC17681
0.8615 High Similarity NPC471559
0.8605 High Similarity NPC476351
0.8605 High Similarity NPC475818
0.8594 High Similarity NPC1848
0.8582 High Similarity NPC97740
0.8527 High Similarity NPC471549
0.8527 High Similarity NPC473379
0.8527 High Similarity NPC283284
0.8527 High Similarity NPC289911
0.8516 High Similarity NPC474817
0.8485 Intermediate Similarity NPC471501
0.8485 Intermediate Similarity NPC473355
0.8485 Intermediate Similarity NPC471573
0.8485 Intermediate Similarity NPC471554
0.845 Intermediate Similarity NPC474136
0.8444 Intermediate Similarity NPC45358
0.8425 Intermediate Similarity NPC44577
0.8397 Intermediate Similarity NPC243269
0.8385 Intermediate Similarity NPC263870
0.838 Intermediate Similarity NPC137295
0.8378 Intermediate Similarity NPC469485
0.8357 Intermediate Similarity NPC282973
0.8346 Intermediate Similarity NPC137570
0.8322 Intermediate Similarity NPC173544
0.8322 Intermediate Similarity NPC45101
0.8321 Intermediate Similarity NPC106247
0.8311 Intermediate Similarity NPC281258
0.8311 Intermediate Similarity NPC214541
0.8311 Intermediate Similarity NPC44675
0.831 Intermediate Similarity NPC267632
0.831 Intermediate Similarity NPC476946
0.8309 Intermediate Similarity NPC471544
0.8309 Intermediate Similarity NPC473344
0.8309 Intermediate Similarity NPC471545
0.8308 Intermediate Similarity NPC79557
0.8299 Intermediate Similarity NPC474378
0.8299 Intermediate Similarity NPC474219
0.8295 Intermediate Similarity NPC473969
0.8286 Intermediate Similarity NPC107571
0.8271 Intermediate Similarity NPC138139
0.8271 Intermediate Similarity NPC46536
0.8267 Intermediate Similarity NPC472779
0.8261 Intermediate Similarity NPC159786
0.8261 Intermediate Similarity NPC92941
0.8258 Intermediate Similarity NPC118853
0.8248 Intermediate Similarity NPC470740
0.8235 Intermediate Similarity NPC89133
0.8212 Intermediate Similarity NPC477402
0.8209 Intermediate Similarity NPC319140
0.8209 Intermediate Similarity NPC95567
0.8209 Intermediate Similarity NPC83178
0.8203 Intermediate Similarity NPC45536
0.82 Intermediate Similarity NPC261597
0.8194 Intermediate Similarity NPC195920
0.8176 Intermediate Similarity NPC147168
0.8175 Intermediate Similarity NPC1811
0.8175 Intermediate Similarity NPC471817
0.8175 Intermediate Similarity NPC26157
0.8158 Intermediate Similarity NPC329938
0.8158 Intermediate Similarity NPC263432
0.8148 Intermediate Similarity NPC207294
0.8148 Intermediate Similarity NPC112706
0.8146 Intermediate Similarity NPC475967
0.8146 Intermediate Similarity NPC477403
0.8143 Intermediate Similarity NPC186626
0.8143 Intermediate Similarity NPC170604
0.8143 Intermediate Similarity NPC470742
0.8143 Intermediate Similarity NPC310830
0.8143 Intermediate Similarity NPC215109
0.814 Intermediate Similarity NPC131801
0.8138 Intermediate Similarity NPC104924
0.8138 Intermediate Similarity NPC346
0.8138 Intermediate Similarity NPC475864
0.8129 Intermediate Similarity NPC14650
0.8125 Intermediate Similarity NPC476944
0.8125 Intermediate Similarity NPC86935
0.812 Intermediate Similarity NPC188377
0.812 Intermediate Similarity NPC65735
0.8112 Intermediate Similarity NPC52412
0.8106 Intermediate Similarity NPC477967
0.8105 Intermediate Similarity NPC292389
0.8105 Intermediate Similarity NPC477405
0.8105 Intermediate Similarity NPC469338
0.8102 Intermediate Similarity NPC136340
0.8099 Intermediate Similarity NPC90296
0.8095 Intermediate Similarity NPC474270
0.8095 Intermediate Similarity NPC475904
0.8095 Intermediate Similarity NPC69647
0.8095 Intermediate Similarity NPC125182
0.8092 Intermediate Similarity NPC25255
0.8092 Intermediate Similarity NPC472653
0.8092 Intermediate Similarity NPC335761
0.8092 Intermediate Similarity NPC470789
0.8085 Intermediate Similarity NPC476943
0.8085 Intermediate Similarity NPC220094
0.8082 Intermediate Similarity NPC255414
0.8079 Intermediate Similarity NPC36655
0.8079 Intermediate Similarity NPC187149
0.8071 Intermediate Similarity NPC146872
0.8071 Intermediate Similarity NPC303217
0.8067 Intermediate Similarity NPC264943
0.806 Intermediate Similarity NPC179354
0.8058 Intermediate Similarity NPC288209
0.8056 Intermediate Similarity NPC254198
0.8052 Intermediate Similarity NPC469849
0.8052 Intermediate Similarity NPC276551
0.8052 Intermediate Similarity NPC470940
0.8045 Intermediate Similarity NPC16922
0.8041 Intermediate Similarity NPC46551
0.8039 Intermediate Similarity NPC82851
0.8039 Intermediate Similarity NPC69028
0.8039 Intermediate Similarity NPC18347
0.8039 Intermediate Similarity NPC5079
0.8039 Intermediate Similarity NPC149896
0.8039 Intermediate Similarity NPC193798
0.8029 Intermediate Similarity NPC21460
0.8028 Intermediate Similarity NPC90953
0.8027 Intermediate Similarity NPC474255
0.8027 Intermediate Similarity NPC471618
0.8027 Intermediate Similarity NPC7388
0.8027 Intermediate Similarity NPC474220
0.8014 Intermediate Similarity NPC42400
0.8 Intermediate Similarity NPC471521
0.8 Intermediate Similarity NPC470875
0.8 Intermediate Similarity NPC476947
0.8 Intermediate Similarity NPC473356
0.7987 Intermediate Similarity NPC39986
0.7987 Intermediate Similarity NPC51568
0.7987 Intermediate Similarity NPC234660
0.7987 Intermediate Similarity NPC302369
0.7987 Intermediate Similarity NPC134254
0.7986 Intermediate Similarity NPC121158
0.7973 Intermediate Similarity NPC472654
0.7961 Intermediate Similarity NPC472776
0.7961 Intermediate Similarity NPC472778
0.7961 Intermediate Similarity NPC249021
0.7961 Intermediate Similarity NPC299038
0.7961 Intermediate Similarity NPC472777
0.7959 Intermediate Similarity NPC476938
0.7959 Intermediate Similarity NPC476937
0.7959 Intermediate Similarity NPC250228
0.7958 Intermediate Similarity NPC236532
0.7953 Intermediate Similarity NPC105249
0.7949 Intermediate Similarity NPC472774
0.7949 Intermediate Similarity NPC472775
0.7949 Intermediate Similarity NPC472282
0.7949 Intermediate Similarity NPC173516
0.7949 Intermediate Similarity NPC472651
0.7945 Intermediate Similarity NPC37488
0.7935 Intermediate Similarity NPC271657
0.7935 Intermediate Similarity NPC476857
0.7935 Intermediate Similarity NPC146991
0.7935 Intermediate Similarity NPC476858
0.7935 Intermediate Similarity NPC476856
0.7935 Intermediate Similarity NPC123088
0.7933 Intermediate Similarity NPC268905
0.7933 Intermediate Similarity NPC33938
0.7931 Intermediate Similarity NPC110305
0.7931 Intermediate Similarity NPC80635
0.7929 Intermediate Similarity NPC471998
0.7922 Intermediate Similarity NPC200782
0.7919 Intermediate Similarity NPC470997
0.7917 Intermediate Similarity NPC205765
0.7914 Intermediate Similarity NPC473982
0.7908 Intermediate Similarity NPC262872
0.7905 Intermediate Similarity NPC476941
0.7905 Intermediate Similarity NPC476942
0.7898 Intermediate Similarity NPC472652
0.7898 Intermediate Similarity NPC160651
0.7898 Intermediate Similarity NPC471397
0.7898 Intermediate Similarity NPC271235
0.7895 Intermediate Similarity NPC126723
0.7895 Intermediate Similarity NPC209364
0.7895 Intermediate Similarity NPC107646
0.7891 Intermediate Similarity NPC262198
0.7881 Intermediate Similarity NPC282445
0.7877 Intermediate Similarity NPC267004
0.7877 Intermediate Similarity NPC218712
0.7877 Intermediate Similarity NPC142113
0.7877 Intermediate Similarity NPC251865
0.7877 Intermediate Similarity NPC307346
0.7877 Intermediate Similarity NPC261733
0.7872 Intermediate Similarity NPC158525

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC474407 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
0.7778 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.753 Intermediate Similarity NPD8434 Phase 2
0.7484 Intermediate Similarity NPD5761 Phase 2
0.7484 Intermediate Similarity NPD5760 Phase 2
0.7431 Intermediate Similarity NPD6355 Discontinued
0.7279 Intermediate Similarity NPD2799 Discontinued
0.7203 Intermediate Similarity NPD6832 Phase 2
0.7192 Intermediate Similarity NPD447 Suspended
0.7183 Intermediate Similarity NPD5647 Approved
0.7152 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7152 Intermediate Similarity NPD4628 Phase 3
0.7143 Intermediate Similarity NPD9717 Approved
0.7124 Intermediate Similarity NPD6799 Approved
0.7103 Intermediate Similarity NPD2313 Discontinued
0.7081 Intermediate Similarity NPD5537 Clinical (unspecified phase)
0.707 Intermediate Similarity NPD6599 Discontinued
0.7067 Intermediate Similarity NPD2344 Approved
0.7055 Intermediate Similarity NPD6233 Phase 2
0.7027 Intermediate Similarity NPD6653 Approved
0.7019 Intermediate Similarity NPD7075 Discontinued
0.6987 Remote Similarity NPD920 Approved
0.6986 Remote Similarity NPD6798 Discontinued
0.6954 Remote Similarity NPD2346 Discontinued
0.6954 Remote Similarity NPD1471 Phase 3
0.6944 Remote Similarity NPD1019 Discontinued
0.6923 Remote Similarity NPD6765 Approved
0.6923 Remote Similarity NPD6764 Approved
0.6918 Remote Similarity NPD7095 Approved
0.6894 Remote Similarity NPD5402 Approved
0.6887 Remote Similarity NPD1551 Phase 2
0.6887 Remote Similarity NPD2935 Discontinued
0.6883 Remote Similarity NPD2309 Approved
0.6883 Remote Similarity NPD2354 Approved
0.6879 Remote Similarity NPD5403 Approved
0.6875 Remote Similarity NPD2797 Approved
0.6875 Remote Similarity NPD1203 Approved
0.6871 Remote Similarity NPD919 Approved
0.6861 Remote Similarity NPD690 Clinical (unspecified phase)
0.6859 Remote Similarity NPD5401 Approved
0.6859 Remote Similarity NPD642 Clinical (unspecified phase)
0.6852 Remote Similarity NPD3882 Suspended
0.6846 Remote Similarity NPD1899 Clinical (unspecified phase)
0.6832 Remote Similarity NPD7972 Discontinued
0.6828 Remote Similarity NPD2798 Approved
0.6824 Remote Similarity NPD6559 Discontinued
0.6824 Remote Similarity NPD4062 Phase 3
0.6821 Remote Similarity NPD4308 Phase 3
0.6797 Remote Similarity NPD5958 Discontinued
0.679 Remote Similarity NPD3817 Phase 2
0.6779 Remote Similarity NPD7966 Clinical (unspecified phase)
0.6774 Remote Similarity NPD3887 Approved
0.677 Remote Similarity NPD6801 Discontinued
0.6763 Remote Similarity NPD6784 Approved
0.6763 Remote Similarity NPD6785 Approved
0.6759 Remote Similarity NPD6362 Approved
0.6757 Remote Similarity NPD411 Approved
0.6757 Remote Similarity NPD3268 Approved
0.6755 Remote Similarity NPD7097 Phase 1
0.6733 Remote Similarity NPD1933 Approved
0.6732 Remote Similarity NPD6005 Phase 3
0.6732 Remote Similarity NPD6006 Clinical (unspecified phase)
0.6732 Remote Similarity NPD6003 Clinical (unspecified phase)
0.6732 Remote Similarity NPD6004 Phase 3
0.6732 Remote Similarity NPD6002 Phase 3
0.6731 Remote Similarity NPD643 Clinical (unspecified phase)
0.6728 Remote Similarity NPD7819 Suspended
0.6714 Remote Similarity NPD9092 Discovery
0.671 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6709 Remote Similarity NPD6273 Approved
0.6709 Remote Similarity NPD5049 Phase 3
0.6707 Remote Similarity NPD3749 Approved
0.6691 Remote Similarity NPD2181 Clinical (unspecified phase)
0.6689 Remote Similarity NPD2598 Clinical (unspecified phase)
0.6688 Remote Similarity NPD4534 Discontinued
0.6687 Remote Similarity NPD1247 Approved
0.6687 Remote Similarity NPD3226 Approved
0.6667 Remote Similarity NPD1608 Approved
0.6667 Remote Similarity NPD4060 Phase 1
0.6667 Remote Similarity NPD2182 Approved
0.6667 Remote Similarity NPD4307 Phase 2
0.6667 Remote Similarity NPD9494 Approved
0.6647 Remote Similarity NPD6808 Phase 2
0.6646 Remote Similarity NPD2534 Approved
0.6646 Remote Similarity NPD7768 Phase 2
0.6646 Remote Similarity NPD2532 Approved
0.6646 Remote Similarity NPD2533 Approved
0.6646 Remote Similarity NPD4378 Clinical (unspecified phase)
0.6645 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6644 Remote Similarity NPD987 Approved
0.6644 Remote Similarity NPD3764 Approved
0.6644 Remote Similarity NPD1049 Clinical (unspecified phase)
0.6643 Remote Similarity NPD9493 Approved
0.6623 Remote Similarity NPD2353 Approved
0.6623 Remote Similarity NPD5763 Approved
0.6623 Remote Similarity NPD5762 Approved
0.6623 Remote Similarity NPD2355 Clinical (unspecified phase)
0.6618 Remote Similarity NPD2067 Discontinued
0.6607 Remote Similarity NPD3926 Phase 2
0.6603 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6603 Remote Similarity NPD4110 Phase 3
0.6603 Remote Similarity NPD6398 Clinical (unspecified phase)
0.6601 Remote Similarity NPD7033 Discontinued
0.6597 Remote Similarity NPD1547 Clinical (unspecified phase)
0.6584 Remote Similarity NPD7458 Discontinued
0.6584 Remote Similarity NPD5808 Clinical (unspecified phase)
0.6581 Remote Similarity NPD2424 Discontinued
0.6575 Remote Similarity NPD1876 Approved
0.6571 Remote Similarity NPD7157 Approved
0.6552 Remote Similarity NPD8312 Approved
0.6552 Remote Similarity NPD8313 Approved
0.6547 Remote Similarity NPD1241 Discontinued
0.6545 Remote Similarity NPD4868 Clinical (unspecified phase)
0.6538 Remote Similarity NPD1243 Approved
0.6533 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6531 Remote Similarity NPD3266 Approved
0.6531 Remote Similarity NPD3267 Approved
0.6528 Remote Similarity NPD3496 Discontinued
0.6527 Remote Similarity NPD5494 Approved
0.6519 Remote Similarity NPD7440 Discontinued
0.651 Remote Similarity NPD8404 Phase 2
0.6506 Remote Similarity NPD4381 Clinical (unspecified phase)
0.6503 Remote Similarity NPD7411 Suspended
0.6503 Remote Similarity NPD5585 Approved
0.6497 Remote Similarity NPD3750 Approved
0.6491 Remote Similarity NPD3818 Discontinued
0.6491 Remote Similarity NPD7893 Clinical (unspecified phase)
0.648 Remote Similarity NPD7879 Clinical (unspecified phase)
0.6477 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6475 Remote Similarity NPD7843 Approved
0.6474 Remote Similarity NPD970 Clinical (unspecified phase)
0.6471 Remote Similarity NPD1358 Approved
0.6471 Remote Similarity NPD4575 Clinical (unspecified phase)
0.6467 Remote Similarity NPD5952 Clinical (unspecified phase)
0.6463 Remote Similarity NPD6280 Approved
0.6463 Remote Similarity NPD1934 Approved
0.6463 Remote Similarity NPD6279 Approved
0.6458 Remote Similarity NPD17 Approved
0.6453 Remote Similarity NPD7804 Clinical (unspecified phase)
0.6452 Remote Similarity NPD6032 Approved
0.6452 Remote Similarity NPD2796 Approved
0.6442 Remote Similarity NPD4380 Phase 2
0.6438 Remote Similarity NPD4661 Approved
0.6438 Remote Similarity NPD4662 Approved
0.6434 Remote Similarity NPD9545 Approved
0.6434 Remote Similarity NPD1894 Discontinued
0.6433 Remote Similarity NPD7473 Discontinued
0.6424 Remote Similarity NPD2801 Approved
0.6424 Remote Similarity NPD1699 Clinical (unspecified phase)
0.6424 Remote Similarity NPD7985 Registered
0.6424 Remote Similarity NPD2393 Clinical (unspecified phase)
0.6423 Remote Similarity NPD2684 Approved
0.6405 Remote Similarity NPD230 Phase 1
0.6405 Remote Similarity NPD4618 Approved
0.6405 Remote Similarity NPD4622 Approved
0.6397 Remote Similarity NPD3134 Approved
0.6392 Remote Similarity NPD7003 Approved
0.6391 Remote Similarity NPD8127 Discontinued
0.6387 Remote Similarity NPD3748 Approved
0.6386 Remote Similarity NPD2296 Approved
0.6386 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6376 Remote Similarity NPD6007 Clinical (unspecified phase)
0.6375 Remote Similarity NPD6143 Clinical (unspecified phase)
0.6374 Remote Similarity NPD6166 Phase 2
0.6374 Remote Similarity NPD6167 Clinical (unspecified phase)
0.6374 Remote Similarity NPD6168 Clinical (unspecified phase)
0.637 Remote Similarity NPD164 Approved
0.6369 Remote Similarity NPD1549 Phase 2
0.6369 Remote Similarity NPD2897 Discontinued
0.6364 Remote Similarity NPD6844 Discontinued
0.6353 Remote Similarity NPD6232 Discontinued
0.6351 Remote Similarity NPD1283 Approved
0.6346 Remote Similarity NPD2438 Suspended
0.6346 Remote Similarity NPD1501 Clinical (unspecified phase)
0.6346 Remote Similarity NPD4477 Approved
0.6346 Remote Similarity NPD5712 Approved
0.6346 Remote Similarity NPD4476 Approved
0.6345 Remote Similarity NPD1778 Approved
0.6343 Remote Similarity NPD7685 Pre-registration
0.634 Remote Similarity NPD2979 Phase 3
0.6335 Remote Similarity NPD7004 Clinical (unspecified phase)
0.6329 Remote Similarity NPD2800 Approved
0.6327 Remote Similarity NPD1481 Phase 2
0.6327 Remote Similarity NPD3972 Approved
0.6325 Remote Similarity NPD8455 Phase 2
0.6325 Remote Similarity NPD1006 Clinical (unspecified phase)
0.6323 Remote Similarity NPD5688 Approved
0.6323 Remote Similarity NPD5689 Approved
0.6316 Remote Similarity NPD7184 Clinical (unspecified phase)
0.6312 Remote Similarity NPD7236 Approved
0.6307 Remote Similarity NPD4338 Clinical (unspecified phase)
0.6306 Remote Similarity NPD1552 Clinical (unspecified phase)
0.6306 Remote Similarity NPD1550 Clinical (unspecified phase)
0.6303 Remote Similarity NPD958 Approved
0.6301 Remote Similarity NPD3751 Discontinued
0.6296 Remote Similarity NPD1512 Approved
0.6291 Remote Similarity NPD2614 Approved
0.6289 Remote Similarity NPD7982 Clinical (unspecified phase)
0.6287 Remote Similarity NPD5616 Clinical (unspecified phase)
0.6286 Remote Similarity NPD7993 Clinical (unspecified phase)
0.6284 Remote Similarity NPD4359 Approved

Structure

External Identifiers

PubChem CID   24850052
ChEMBL   CHEMBL467135
ZINC  

Physicochemical Properties

Molecular Weight:  478.29
ALogP:  1.5076
MLogP:  3.66
XLogP:  5.062
# Rotatable Bonds:  25
Polar Surface Area:  106.2
# H-Bond Aceptor:  6
# H-Bond Donor:  2
# Rings:  1
# Heavy Atoms:  34

Download Data

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Biological Activities  
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