Natural Product: NPC87755

Natural Product ID:  NPC87755
Common Name:   Longicaudatine F
IUPAC Name:  
Synonyms:   Longicaudatine F
Molecular Formula:   C38H42N4O
Standard InCHIKey:  PYNCAWTWBZEHSV-SWDFVQBTSA-N
Standard InCHI:  InChI=1S/C38H42N4O/c1-3-22-19-40-15-13-25-24-9-5-7-11-30(24)39-35(25)32(40)17-26(22)28-21-42-31-12-8-6-10-29(31)38-14-16-41-20-23(4-2)27(18-33(38)41)34(36(28)43)37(38)42/h3-12,21,26-27,32-34,36-37,39,43H,13-20H2,1-2H3/b22-3-,23-4-/t26-,27-,32-,33-,34-,36+,37-,38+/m0/s1
Canonical SMILES:  C/C=C1/CN2CCc3c([C@@H]2C[C@@H]1C1=CN2c4ccccc4[C@]45[C@@H]2[C@H]([C@@H]1O)[C@H]1C[C@@H]5N(C/C/1=C/C)CC4)[nH]c1c3cccc1
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
NPO32538 strychnos longicaudata Species Loganiaceae Eukaryota PMID[12398531]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT6 Organism Plasmodium falciparum Plasmodium falciparum IC90 = 28100 nM 22694318
NPT6 Organism Plasmodium falciparum Plasmodium falciparum IC50 = 11700 nM 15711537
NPT6 Organism Plasmodium falciparum Plasmodium falciparum IC90 = 33400 nM 18183025
NPT6 Organism Plasmodium falciparum Plasmodium falciparum IC50 = 7700 nM 26000707
NPT6 Organism Plasmodium falciparum Plasmodium falciparum IC90 = 26700 nM 25856683
NPT6 Organism Plasmodium falciparum Plasmodium falciparum IC50 = 9580 nM 21615147

  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 NPC87755 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
0.9892 High Similarity NPC475422
0.9372 High Similarity NPC126066
0.8557 High Similarity NPC475602
0.8424 Intermediate Similarity NPC472123
0.8404 Intermediate Similarity NPC19679
0.8263 Intermediate Similarity NPC472294
0.8211 Intermediate Similarity NPC472108
0.8211 Intermediate Similarity NPC139291
0.8204 Intermediate Similarity NPC183407
0.8182 Intermediate Similarity NPC329688
0.8182 Intermediate Similarity NPC189812
0.816 Intermediate Similarity NPC476492
0.816 Intermediate Similarity NPC470126
0.8095 Intermediate Similarity NPC326575
0.8095 Intermediate Similarity NPC471506
0.8081 Intermediate Similarity NPC232130
0.8079 Intermediate Similarity NPC166492
0.8079 Intermediate Similarity NPC473362
0.8057 Intermediate Similarity NPC162748
0.8051 Intermediate Similarity NPC95783
0.7968 Intermediate Similarity NPC317430
0.7959 Intermediate Similarity NPC469501
0.7959 Intermediate Similarity NPC469470
0.7953 Intermediate Similarity NPC253580
0.7927 Intermediate Similarity NPC472109
0.7927 Intermediate Similarity NPC472110
0.7913 Intermediate Similarity NPC476116
0.7867 Intermediate Similarity NPC471564
0.7865 Intermediate Similarity NPC133261
0.7861 Intermediate Similarity NPC265576
0.7857 Intermediate Similarity NPC472027
0.7847 Intermediate Similarity NPC473757
0.7838 Intermediate Similarity NPC474880
0.7838 Intermediate Similarity NPC221786
0.7838 Intermediate Similarity NPC475990
0.7824 Intermediate Similarity NPC187827
0.7824 Intermediate Similarity NPC472105
0.781 Intermediate Similarity NPC250835
0.7796 Intermediate Similarity NPC229173
0.7783 Intermediate Similarity NPC249040
0.7783 Intermediate Similarity NPC477714
0.7773 Intermediate Similarity NPC251936
0.7772 Intermediate Similarity NPC52557
0.7763 Intermediate Similarity NPC476493
0.776 Intermediate Similarity NPC24594
0.776 Intermediate Similarity NPC472122
0.7749 Intermediate Similarity NPC34508
0.7737 Intermediate Similarity NPC280548
0.7737 Intermediate Similarity NPC474897
0.7732 Intermediate Similarity NPC300688
0.7729 Intermediate Similarity NPC477065
0.7708 Intermediate Similarity NPC475097
0.77 Intermediate Similarity NPC473310
0.7696 Intermediate Similarity NPC313985
0.7696 Intermediate Similarity NPC195461
0.7696 Intermediate Similarity NPC81654
0.7696 Intermediate Similarity NPC249150
0.7696 Intermediate Similarity NPC49196
0.7696 Intermediate Similarity NPC79129
0.7685 Intermediate Similarity NPC50503
0.7684 Intermediate Similarity NPC154293
0.768 Intermediate Similarity NPC215795
0.768 Intermediate Similarity NPC176199
0.7672 Intermediate Similarity NPC470508
0.766 Intermediate Similarity NPC16667
0.7656 Intermediate Similarity NPC97525
0.7653 Intermediate Similarity NPC477715
0.7641 Intermediate Similarity NPC198339
0.7634 Intermediate Similarity NPC285469
0.7629 Intermediate Similarity NPC151939
0.7606 Intermediate Similarity NPC81229
0.7606 Intermediate Similarity NPC255229
0.7596 Intermediate Similarity NPC475288
0.7592 Intermediate Similarity NPC201700
0.759 Intermediate Similarity NPC472443
0.759 Intermediate Similarity NPC270009
0.7576 Intermediate Similarity NPC15102
0.7574 Intermediate Similarity NPC474177
0.757 Intermediate Similarity NPC476041
0.757 Intermediate Similarity NPC304926
0.7563 Intermediate Similarity NPC472444
0.7553 Intermediate Similarity NPC67056
0.7544 Intermediate Similarity NPC469734
0.7538 Intermediate Similarity NPC59269
0.7526 Intermediate Similarity NPC472586
0.7526 Intermediate Similarity NPC275305
0.7526 Intermediate Similarity NPC37423
0.7524 Intermediate Similarity NPC314957
0.7522 Intermediate Similarity NPC81175
0.7513 Intermediate Similarity NPC192270
0.7512 Intermediate Similarity NPC472112
0.75 Intermediate Similarity NPC475258
0.75 Intermediate Similarity NPC6215
0.7488 Intermediate Similarity NPC162860
0.7487 Intermediate Similarity NPC207726
0.7478 Intermediate Similarity NPC477861
0.7466 Intermediate Similarity NPC33949
0.7466 Intermediate Similarity NPC191382
0.7466 Intermediate Similarity NPC56109
0.7463 Intermediate Similarity NPC46413
0.7463 Intermediate Similarity NPC175474
0.7463 Intermediate Similarity NPC229332
0.7455 Intermediate Similarity NPC909
0.7455 Intermediate Similarity NPC475338
0.7451 Intermediate Similarity NPC195314
0.7451 Intermediate Similarity NPC133366
0.7449 Intermediate Similarity NPC68354
0.7438 Intermediate Similarity NPC472113
0.7437 Intermediate Similarity NPC165201
0.7419 Intermediate Similarity NPC33421
0.7415 Intermediate Similarity NPC231342
0.7413 Intermediate Similarity NPC119700
0.7411 Intermediate Similarity NPC6093
0.7409 Intermediate Similarity NPC63751
0.7409 Intermediate Similarity NPC313884
0.7409 Intermediate Similarity NPC98371
0.7406 Intermediate Similarity NPC223791
0.7406 Intermediate Similarity NPC107077
0.7404 Intermediate Similarity NPC475506
0.7398 Intermediate Similarity NPC280852
0.7397 Intermediate Similarity NPC155444
0.7394 Intermediate Similarity NPC470507
0.7393 Intermediate Similarity NPC54420
0.7391 Intermediate Similarity NPC32200
0.7387 Intermediate Similarity NPC472104
0.7385 Intermediate Similarity NPC473880
0.7376 Intermediate Similarity NPC173028
0.7376 Intermediate Similarity NPC34271
0.7376 Intermediate Similarity NPC65215
0.7374 Intermediate Similarity NPC15840
0.7371 Intermediate Similarity NPC194411
0.7368 Intermediate Similarity NPC193761
0.7368 Intermediate Similarity NPC155143
0.7368 Intermediate Similarity NPC162730
0.736 Intermediate Similarity NPC293472
0.7359 Intermediate Similarity NPC471891
0.7358 Intermediate Similarity NPC474561
0.7358 Intermediate Similarity NPC49954
0.7354 Intermediate Similarity NPC477175
0.7354 Intermediate Similarity NPC470730
0.7349 Intermediate Similarity NPC469592
0.7349 Intermediate Similarity NPC471080
0.7344 Intermediate Similarity NPC472587
0.7343 Intermediate Similarity NPC473640
0.7342 Intermediate Similarity NPC476491
0.734 Intermediate Similarity NPC206967
0.7337 Intermediate Similarity NPC302191
0.733 Intermediate Similarity NPC205403
0.7327 Intermediate Similarity NPC204565
0.7327 Intermediate Similarity NPC317030
0.7321 Intermediate Similarity NPC475969
0.7321 Intermediate Similarity NPC475859
0.7321 Intermediate Similarity NPC476451
0.7306 Intermediate Similarity NPC475420
0.7302 Intermediate Similarity NPC75634
0.7302 Intermediate Similarity NPC38736
0.7297 Intermediate Similarity NPC264589
0.7296 Intermediate Similarity NPC314603
0.7289 Intermediate Similarity NPC165743
0.7286 Intermediate Similarity NPC474116
0.7277 Intermediate Similarity NPC474707
0.7277 Intermediate Similarity NPC475910
0.7273 Intermediate Similarity NPC254240
0.7273 Intermediate Similarity NPC199851
0.7273 Intermediate Similarity NPC294909
0.7273 Intermediate Similarity NPC37548
0.7273 Intermediate Similarity NPC128265
0.7273 Intermediate Similarity NPC312870
0.7268 Intermediate Similarity NPC160105
0.7268 Intermediate Similarity NPC471386
0.7268 Intermediate Similarity NPC54988
0.726 Intermediate Similarity NPC171317
0.726 Intermediate Similarity NPC473747
0.7255 Intermediate Similarity NPC329858
0.7255 Intermediate Similarity NPC314333
0.725 Intermediate Similarity NPC314394
0.725 Intermediate Similarity NPC233936
0.724 Intermediate Similarity NPC280272
0.7238 Intermediate Similarity NPC300183
0.7228 Intermediate Similarity NPC476319
0.7225 Intermediate Similarity NPC100321
0.7222 Intermediate Similarity NPC203754
0.7222 Intermediate Similarity NPC288785
0.7222 Intermediate Similarity NPC150048
0.722 Intermediate Similarity NPC243716
0.7219 Intermediate Similarity NPC21605
0.7215 Intermediate Similarity NPC469594
0.7209 Intermediate Similarity NPC234999
0.7206 Intermediate Similarity NPC102338
0.7206 Intermediate Similarity NPC213629
0.7206 Intermediate Similarity NPC111602
0.7206 Intermediate Similarity NPC196251
0.7206 Intermediate Similarity NPC63199
0.7205 Intermediate Similarity NPC41679
0.7202 Intermediate Similarity NPC282231
0.7198 Intermediate Similarity NPC181502
0.7198 Intermediate Similarity NPC85066
0.7195 Intermediate Similarity NPC474896
0.7188 Intermediate Similarity NPC469720
0.7181 Intermediate Similarity NPC187951

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC87755 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
0.7957 Intermediate Similarity NPD5744 Clinical (unspecified phase)
0.7824 Intermediate Similarity NPD8464 Clinical (unspecified phase)
0.7755 Intermediate Similarity NPD6610 Clinical (unspecified phase)
0.7752 Intermediate Similarity NPD7824 Approved
0.7727 Intermediate Similarity NPD7950 Approved
0.7727 Intermediate Similarity NPD7789 Approved
0.7727 Intermediate Similarity NPD7790 Approved
0.7727 Intermediate Similarity NPD7953 Approved
0.7727 Intermediate Similarity NPD7791 Approved
0.7727 Intermediate Similarity NPD7952 Approved
0.7727 Intermediate Similarity NPD7951 Approved
0.7696 Intermediate Similarity NPD4601 Approved
0.7696 Intermediate Similarity NPD4600 Approved
0.7668 Intermediate Similarity NPD6375 Clinical (unspecified phase)
0.7661 Intermediate Similarity NPD7731 Approved
0.7661 Intermediate Similarity NPD7730 Approved
0.765 Intermediate Similarity NPD7271 Approved
0.75 Intermediate Similarity NPD4079 Approved
0.75 Intermediate Similarity NPD8431 Approved
0.75 Intermediate Similarity NPD4076 Approved
0.7474 Intermediate Similarity NPD4112 Clinical (unspecified phase)
0.7466 Intermediate Similarity NPD7781 Approved
0.7466 Intermediate Similarity NPD7780 Approved
0.7462 Intermediate Similarity NPD6595 Phase 3
0.7461 Intermediate Similarity NPD1325 Approved
0.7461 Intermediate Similarity NPD1326 Approved
0.7449 Intermediate Similarity NPD3505 Approved
0.7449 Intermediate Similarity NPD6203 Clinical (unspecified phase)
0.7449 Intermediate Similarity NPD3506 Approved
0.7441 Intermediate Similarity NPD7947 Clinical (unspecified phase)
0.7421 Intermediate Similarity NPD6978 Phase 2
0.7421 Intermediate Similarity NPD6977 Clinical (unspecified phase)
0.7411 Intermediate Similarity NPD8386 Phase 2
0.7409 Intermediate Similarity NPD6976 Clinical (unspecified phase)
0.7393 Intermediate Similarity NPD8322 Phase 2
0.7389 Intermediate Similarity NPD6630 Clinical (unspecified phase)
0.7387 Intermediate Similarity NPD5522 Clinical (unspecified phase)
0.7347 Intermediate Similarity NPD5065 Approved
0.7346 Intermediate Similarity NPD7957 Phase 1
0.7346 Intermediate Similarity NPD7958 Clinical (unspecified phase)
0.7299 Intermediate Similarity NPD8114 Approved
0.7299 Intermediate Similarity NPD8115 Approved
0.7285 Intermediate Similarity NPD7717 Approved
0.7285 Intermediate Similarity NPD7716 Approved
0.7273 Intermediate Similarity NPD4181 Approved
0.7273 Intermediate Similarity NPD4500 Approved
0.7273 Intermediate Similarity NPD4501 Approved
0.726 Intermediate Similarity NPD7889 Clinical (unspecified phase)
0.7255 Intermediate Similarity NPD4499 Approved
0.7254 Intermediate Similarity NPD3323 Discontinued
0.723 Intermediate Similarity NPD6838 Clinical (unspecified phase)
0.7206 Intermediate Similarity NPD8110 Clinical (unspecified phase)
0.7189 Intermediate Similarity NPD8488 Clinical (unspecified phase)
0.7172 Intermediate Similarity NPD4128 Approved
0.7157 Intermediate Similarity NPD3961 Discontinued
0.7156 Intermediate Similarity NPD4511 Phase 1
0.715 Intermediate Similarity NPD8493 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD4640 Approved
0.7143 Intermediate Similarity NPD8396 Approved
0.7143 Intermediate Similarity NPD4639 Approved
0.7143 Intermediate Similarity NPD8395 Approved
0.7143 Intermediate Similarity NPD8458 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD4638 Approved
0.7136 Intermediate Similarity NPD5913 Phase 3
0.7136 Intermediate Similarity NPD2381 Approved
0.7136 Intermediate Similarity NPD2380 Approved
0.7136 Intermediate Similarity NPD5912 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD2382 Approved
0.7129 Intermediate Similarity NPD5596 Phase 2
0.7123 Intermediate Similarity NPD5721 Clinical (unspecified phase)
0.7107 Intermediate Similarity NPD4184 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD2882 Phase 1
0.7089 Intermediate Similarity NPD4886 Phase 2
0.7087 Intermediate Similarity NPD6281 Approved
0.7081 Intermediate Similarity NPD6449 Clinical (unspecified phase)
0.7079 Intermediate Similarity NPD7867 Phase 1
0.7078 Intermediate Similarity NPD8112 Clinical (unspecified phase)
0.7078 Intermediate Similarity NPD7073 Clinical (unspecified phase)
0.7073 Intermediate Similarity NPD6141 Clinical (unspecified phase)
0.7073 Intermediate Similarity NPD8021 Approved
0.7073 Intermediate Similarity NPD8020 Approved
0.7073 Intermediate Similarity NPD3486 Clinical (unspecified phase)
0.7071 Intermediate Similarity NPD5934 Clinical (unspecified phase)
0.7064 Intermediate Similarity NPD8358 Approved
0.7064 Intermediate Similarity NPD7594 Clinical (unspecified phase)
0.7062 Intermediate Similarity NPD6661 Clinical (unspecified phase)
0.7061 Intermediate Similarity NPD8363 Approved
0.7061 Intermediate Similarity NPD8364 Approved
0.7056 Intermediate Similarity NPD5021 Discontinued
0.7053 Intermediate Similarity NPD4463 Approved
0.7053 Intermediate Similarity NPD4462 Approved
0.7048 Intermediate Similarity NPD7948 Phase 1
0.7037 Intermediate Similarity NPD7665 Phase 2
0.7037 Intermediate Similarity NPD7666 Phase 3
0.7033 Intermediate Similarity NPD7944 Discontinued
0.703 Intermediate Similarity NPD6277 Clinical (unspecified phase)
0.7019 Intermediate Similarity NPD3404 Approved
0.7016 Intermediate Similarity NPD6476 Clinical (unspecified phase)
0.7016 Intermediate Similarity NPD6158 Phase 2
0.7005 Intermediate Similarity NPD4637 Clinical (unspecified phase)
0.7004 Intermediate Similarity NPD8365 Clinical (unspecified phase)
0.6995 Remote Similarity NPD8408 Discontinued
0.699 Remote Similarity NPD5138 Approved
0.699 Remote Similarity NPD5140 Approved
0.6986 Remote Similarity NPD5575 Clinical (unspecified phase)
0.6986 Remote Similarity NPD8093 Discontinued
0.6981 Remote Similarity NPD4118 Clinical (unspecified phase)
0.6981 Remote Similarity NPD7621 Clinical (unspecified phase)
0.6977 Remote Similarity NPD5426 Phase 3
0.6976 Remote Similarity NPD6227 Discontinued
0.6972 Remote Similarity NPD7809 Clinical (unspecified phase)
0.697 Remote Similarity NPD4779 Clinical (unspecified phase)
0.697 Remote Similarity NPD5069 Clinical (unspecified phase)
0.6968 Remote Similarity NPD5254 Discontinued
0.6965 Remote Similarity NPD4075 Phase 2
0.6964 Remote Similarity NPD7726 Phase 1
0.6955 Remote Similarity NPD8094 Discontinued
0.6952 Remote Similarity NPD4602 Approved
0.6951 Remote Similarity NPD6455 Phase 3
0.695 Remote Similarity NPD7418 Discontinued
0.6946 Remote Similarity NPD5473 Discontinued
0.6937 Remote Similarity NPD7823 Clinical (unspecified phase)
0.6935 Remote Similarity NPD7474 Suspended
0.6931 Remote Similarity NPD8123 Approved
0.6931 Remote Similarity NPD2144 Approved
0.6931 Remote Similarity NPD8122 Approved
0.692 Remote Similarity NPD6717 Clinical (unspecified phase)
0.6915 Remote Similarity NPD6492 Phase 2
0.6912 Remote Similarity NPD3038 Discontinued
0.6909 Remote Similarity NPD7454 Approved
0.6909 Remote Similarity NPD7455 Approved
0.6906 Remote Similarity NPD8109 Clinical (unspecified phase)
0.6898 Remote Similarity NPD8272 Phase 2
0.6895 Remote Similarity NPD1683 Approved
0.6878 Remote Similarity NPD5728 Clinical (unspecified phase)
0.6875 Remote Similarity NPD6965 Clinical (unspecified phase)
0.6872 Remote Similarity NPD7619 Phase 3
0.6872 Remote Similarity NPD7618 Phase 3
0.6864 Remote Similarity NPD7470 Discontinued
0.6861 Remote Similarity NPD7423 Phase 2
0.6861 Remote Similarity NPD8000 Clinical (unspecified phase)
0.6858 Remote Similarity NPD6995 Phase 1
0.6852 Remote Similarity NPD8072 Approved
0.6849 Remote Similarity NPD2125 Clinical (unspecified phase)
0.684 Remote Similarity NPD7935 Phase 2
0.6839 Remote Similarity NPD8402 Approved
0.6839 Remote Similarity NPD8400 Approved
0.6839 Remote Similarity NPD8401 Approved
0.6835 Remote Similarity NPD8410 Clinical (unspecified phase)
0.6833 Remote Similarity NPD3330 Phase 1
0.683 Remote Similarity NPD8405 Clinical (unspecified phase)
0.6827 Remote Similarity NPD2383 Phase 1
0.6825 Remote Similarity NPD8467 Approved
0.6825 Remote Similarity NPD8466 Approved
0.6825 Remote Similarity NPD8465 Approved
0.682 Remote Similarity NPD7712 Clinical (unspecified phase)
0.682 Remote Similarity NPD5901 Discontinued
0.6816 Remote Similarity NPD6827 Clinical (unspecified phase)
0.6816 Remote Similarity NPD6828 Phase 2
0.6816 Remote Similarity NPD3609 Approved
0.6816 Remote Similarity NPD3610 Approved
0.6812 Remote Similarity NPD6344 Clinical (unspecified phase)
0.6809 Remote Similarity NPD3943 Clinical (unspecified phase)
0.6808 Remote Similarity NPD6664 Approved
0.6806 Remote Similarity NPD7469 Discontinued
0.6804 Remote Similarity NPD2837 Discontinued
0.6804 Remote Similarity NPD2916 Discontinued
0.68 Remote Similarity NPD7194 Discontinued
0.6788 Remote Similarity NPD2172 Phase 1
0.6787 Remote Similarity NPD8013 Clinical (unspecified phase)
0.6776 Remote Similarity NPD3230 Clinical (unspecified phase)
0.6769 Remote Similarity NPD6285 Phase 2
0.6765 Remote Similarity NPD7921 Approved
0.6763 Remote Similarity NPD6503 Clinical (unspecified phase)
0.6762 Remote Similarity NPD8063 Discontinued
0.6759 Remote Similarity NPD7817 Phase 1
0.6754 Remote Similarity NPD6850 Phase 2
0.6754 Remote Similarity NPD6849 Phase 2
0.6746 Remote Similarity NPD3002 Clinical (unspecified phase)
0.6744 Remote Similarity NPD3814 Phase 1
0.6744 Remote Similarity NPD6248 Phase 2
0.6744 Remote Similarity NPD6249 Phase 2
0.6744 Remote Similarity NPD6999 Discontinued
0.6744 Remote Similarity NPD7000 Clinical (unspecified phase)
0.6742 Remote Similarity NPD7998 Clinical (unspecified phase)
0.6742 Remote Similarity NPD8321 Discontinued
0.6741 Remote Similarity NPD7112 Discontinued
0.6737 Remote Similarity NPD8016 Phase 3
0.6737 Remote Similarity NPD8017 Clinical (unspecified phase)
0.6736 Remote Similarity NPD4374 Clinical (unspecified phase)
0.6736 Remote Similarity NPD3100 Discontinued
0.6735 Remote Similarity NPD6026 Approved
0.6731 Remote Similarity NPD3082 Discontinued
0.6731 Remote Similarity NPD7424 Clinical (unspecified phase)
0.6729 Remote Similarity NPD7081 Clinical (unspecified phase)
0.6728 Remote Similarity NPD8073 Approved
0.6719 Remote Similarity NPD8459 Approved
0.6719 Remote Similarity NPD8425 Approved
0.6719 Remote Similarity NPD8460 Approved
0.6719 Remote Similarity NPD8426 Approved

Structure

External Identifiers

PubChem CID   44559869
ChEMBL   CHEMBL451869
ZINC  

Physicochemical Properties

Molecular Weight:  570.34
ALogP:  0.3596
MLogP:  5.09
XLogP:  5.88
# Rotatable Bonds:  4
Polar Surface Area:  45.74
# H-Bond Aceptor:  5
# H-Bond Donor:  2
# Rings:  10
# Heavy Atoms:  43

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
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Biological Activities  
Similar NPs/Drugs