Natural Product: NPC271862

Natural Product ID:  NPC271862
Common Name:   Cytoglobosin E
IUPAC Name:  
Synonyms:   Cytoglobosin E
Molecular Formula:   C32H36N2O5
Standard InCHIKey:  HBNDUJJOOQPFON-VTIMCAMGSA-N
Standard InCHI:  InChI=1S/C32H36N2O5/c1-18-7-6-8-23-14-22(17-35)20(3)29-26(15-21-16-33-25-10-5-4-9-24(21)25)34-31(39)32(23,29)28(37)12-11-27(36)30(38)19(2)13-18/h4-6,8-10,13-14,16,18,20,23,26,29,33,35H,7,11-12,15,17H2,1-3H3,(H,34,39)/b8-6+,19-13+/t18-,20+,23-,26-,29-,32+/m0/s1
Canonical SMILES:  OCC1=C[C@@H]2/C=C/C[C@H](C)/C=C(/C(=O)C(=O)CCC(=O)[C@]32[C@@H]([C@@H]1C)[C@@H](N=C3O)Cc1c[nH]c2c1cccc2)C
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
NPO997 Peltodon longipes Species Lamiaceae Eukaryota UNPD*
NPO23741 Aspergillus violaceus Species Aspergillaceae Eukaryota UNPD*
NPO24171 Chaetomium globosum Species Chaetomiaceae Eukaryota PMID[20225834]
NPO1920 Podocarpus elongata Species Podocarpaceae Eukaryota UNPD*
NPO2853 Eschweilera coriacea Species Lecythidaceae Eukaryota UNPD*
NPO3809 Eucalyptus cladocalyx Species Myrtaceae Eukaryota UNPD*
NPO5665 Ulva pertusa Species Ulvaceae Eukaryota UNPD*
NPO6621 Salvadora persica Species Salvadoraceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT81 Cell Line A549 Homo sapiens IC50 > 10000 nM 20225834

  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 NPC271862 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
0.9684 High Similarity NPC267965
0.9583 High Similarity NPC132211
0.9524 High Similarity NPC127677
0.9524 High Similarity NPC258062
0.9519 High Similarity NPC98715
0.9471 High Similarity NPC46225
0.9471 High Similarity NPC225821
0.9427 High Similarity NPC151976
0.9427 High Similarity NPC87856
0.9351 High Similarity NPC11445
0.9297 High Similarity NPC157828
0.9297 High Similarity NPC195239
0.9282 High Similarity NPC203614
0.9282 High Similarity NPC204491
0.905 High Similarity NPC2395
0.8916 High Similarity NPC141428
0.8916 High Similarity NPC235885
0.8906 High Similarity NPC300183
0.8867 High Similarity NPC147446
0.8867 High Similarity NPC266192
0.8829 High Similarity NPC57690
0.878 High Similarity NPC267926
0.8349 Intermediate Similarity NPC290529
0.8201 Intermediate Similarity NPC213468
0.8118 Intermediate Similarity NPC201700
0.8112 Intermediate Similarity NPC47190
0.81 Intermediate Similarity NPC252338
0.8071 Intermediate Similarity NPC267343
0.8053 Intermediate Similarity NPC151939
0.8018 Intermediate Similarity NPC70155
0.801 Intermediate Similarity NPC154339
0.8 Intermediate Similarity NPC131887
0.799 Intermediate Similarity NPC280290
0.7969 Intermediate Similarity NPC300688
0.795 Intermediate Similarity NPC227582
0.7944 Intermediate Similarity NPC476818
0.7931 Intermediate Similarity NPC476874
0.7931 Intermediate Similarity NPC260900
0.7915 Intermediate Similarity NPC473310
0.791 Intermediate Similarity NPC477041
0.791 Intermediate Similarity NPC477044
0.7882 Intermediate Similarity NPC475506
0.7872 Intermediate Similarity NPC160105
0.7857 Intermediate Similarity NPC235684
0.7843 Intermediate Similarity NPC155143
0.7838 Intermediate Similarity NPC469762
0.7822 Intermediate Similarity NPC473640
0.7812 Intermediate Similarity NPC267885
0.7801 Intermediate Similarity NPC314603
0.7788 Intermediate Similarity NPC476491
0.7784 Intermediate Similarity NPC469785
0.7783 Intermediate Similarity NPC74413
0.7783 Intermediate Similarity NPC477045
0.7778 Intermediate Similarity NPC474561
0.7778 Intermediate Similarity NPC49954
0.7766 Intermediate Similarity NPC311276
0.7766 Intermediate Similarity NPC315555
0.7761 Intermediate Similarity NPC133366
0.776 Intermediate Similarity NPC203468
0.776 Intermediate Similarity NPC110500
0.776 Intermediate Similarity NPC149155
0.7739 Intermediate Similarity NPC95783
0.7737 Intermediate Similarity NPC78020
0.7732 Intermediate Similarity NPC283219
0.7732 Intermediate Similarity NPC55772
0.7732 Intermediate Similarity NPC126709
0.7732 Intermediate Similarity NPC248041
0.773 Intermediate Similarity NPC70922
0.773 Intermediate Similarity NPC211572
0.773 Intermediate Similarity NPC75540
0.773 Intermediate Similarity NPC212376
0.773 Intermediate Similarity NPC80597
0.7711 Intermediate Similarity NPC474177
0.7703 Intermediate Similarity NPC162860
0.7703 Intermediate Similarity NPC107077
0.7703 Intermediate Similarity NPC223791
0.7696 Intermediate Similarity NPC100321
0.7692 Intermediate Similarity NPC54420
0.7689 Intermediate Similarity NPC474412
0.7688 Intermediate Similarity NPC321708
0.7688 Intermediate Similarity NPC213629
0.7684 Intermediate Similarity NPC54988
0.7681 Intermediate Similarity NPC477043
0.768 Intermediate Similarity NPC111275
0.7676 Intermediate Similarity NPC469786
0.7676 Intermediate Similarity NPC25008
0.7676 Intermediate Similarity NPC73952
0.7676 Intermediate Similarity NPC469760
0.7676 Intermediate Similarity NPC469763
0.7676 Intermediate Similarity NPC469765
0.7676 Intermediate Similarity NPC259644
0.7673 Intermediate Similarity NPC202812
0.7672 Intermediate Similarity NPC40779
0.767 Intermediate Similarity NPC476073
0.7659 Intermediate Similarity NPC470497
0.7656 Intermediate Similarity NPC6982
0.7653 Intermediate Similarity NPC71037
0.765 Intermediate Similarity NPC206967
0.7641 Intermediate Similarity NPC215795
0.7641 Intermediate Similarity NPC176199
0.7638 Intermediate Similarity NPC317030
0.7638 Intermediate Similarity NPC278434
0.7626 Intermediate Similarity NPC188387
0.7626 Intermediate Similarity NPC163421
0.7619 Intermediate Similarity NPC478158
0.7619 Intermediate Similarity NPC282231
0.7617 Intermediate Similarity NPC313791
0.7617 Intermediate Similarity NPC472285
0.761 Intermediate Similarity NPC293917
0.7606 Intermediate Similarity NPC230869
0.76 Intermediate Similarity NPC173028
0.76 Intermediate Similarity NPC65215
0.7594 Intermediate Similarity NPC219087
0.759 Intermediate Similarity NPC84827
0.759 Intermediate Similarity NPC14113
0.759 Intermediate Similarity NPC145885
0.7588 Intermediate Similarity NPC99428
0.7588 Intermediate Similarity NPC94752
0.7583 Intermediate Similarity NPC234999
0.7581 Intermediate Similarity NPC477714
0.7579 Intermediate Similarity NPC194640
0.7579 Intermediate Similarity NPC102423
0.7576 Intermediate Similarity NPC228835
0.7568 Intermediate Similarity NPC24678
0.7568 Intermediate Similarity NPC105818
0.7566 Intermediate Similarity NPC279918
0.7563 Intermediate Similarity NPC233936
0.7562 Intermediate Similarity NPC83111
0.7561 Intermediate Similarity NPC67288
0.7561 Intermediate Similarity NPC171317
0.7561 Intermediate Similarity NPC265576
0.7559 Intermediate Similarity NPC229348
0.7552 Intermediate Similarity NPC63751
0.7551 Intermediate Similarity NPC472443
0.755 Intermediate Similarity NPC204565
0.7547 Intermediate Similarity NPC320968
0.7526 Intermediate Similarity NPC34508
0.7525 Intermediate Similarity NPC117244
0.7525 Intermediate Similarity NPC473763
0.7525 Intermediate Similarity NPC472444
0.7513 Intermediate Similarity NPC477042
0.7512 Intermediate Similarity NPC75634
0.7512 Intermediate Similarity NPC229332
0.7512 Intermediate Similarity NPC175474
0.75 Intermediate Similarity NPC474707
0.75 Intermediate Similarity NPC62749
0.75 Intermediate Similarity NPC281049
0.75 Intermediate Similarity NPC264285
0.75 Intermediate Similarity NPC193761
0.7488 Intermediate Similarity NPC195461
0.7488 Intermediate Similarity NPC81654
0.7488 Intermediate Similarity NPC79129
0.7488 Intermediate Similarity NPC249150
0.7488 Intermediate Similarity NPC313985
0.7488 Intermediate Similarity NPC49196
0.7476 Intermediate Similarity NPC52557
0.7476 Intermediate Similarity NPC470499
0.7476 Intermediate Similarity NPC50503
0.7474 Intermediate Similarity NPC131718
0.7474 Intermediate Similarity NPC470498
0.7466 Intermediate Similarity NPC475258
0.7463 Intermediate Similarity NPC17059
0.7462 Intermediate Similarity NPC270009
0.7454 Intermediate Similarity NPC477715
0.7443 Intermediate Similarity NPC16352
0.7442 Intermediate Similarity NPC478157
0.7442 Intermediate Similarity NPC313640
0.7441 Intermediate Similarity NPC473362
0.7441 Intermediate Similarity NPC166492
0.7441 Intermediate Similarity NPC88008
0.7438 Intermediate Similarity NPC138370
0.7437 Intermediate Similarity NPC469358
0.7437 Intermediate Similarity NPC19679
0.7437 Intermediate Similarity NPC163055
0.7431 Intermediate Similarity NPC276657
0.743 Intermediate Similarity NPC475778
0.743 Intermediate Similarity NPC207020
0.7429 Intermediate Similarity NPC473376
0.7424 Intermediate Similarity NPC198339
0.7421 Intermediate Similarity NPC319232
0.7421 Intermediate Similarity NPC24370
0.7421 Intermediate Similarity NPC475338
0.7421 Intermediate Similarity NPC472762
0.7421 Intermediate Similarity NPC909
0.7416 Intermediate Similarity NPC328596
0.7416 Intermediate Similarity NPC328318
0.7416 Intermediate Similarity NPC474116
0.7411 Intermediate Similarity NPC284775
0.7411 Intermediate Similarity NPC64436
0.7411 Intermediate Similarity NPC59269
0.7411 Intermediate Similarity NPC68354
0.7407 Intermediate Similarity NPC285469
0.7406 Intermediate Similarity NPC314957
0.7406 Intermediate Similarity NPC171787
0.7404 Intermediate Similarity NPC315491
0.7404 Intermediate Similarity NPC213308
0.7404 Intermediate Similarity NPC45459
0.7401 Intermediate Similarity NPC41679
0.7398 Intermediate Similarity NPC275305
0.7398 Intermediate Similarity NPC37423

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC271862 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
0.7979 Intermediate Similarity NPD5728 Clinical (unspecified phase)
0.7938 Intermediate Similarity NPD2096 Phase 2
0.7938 Intermediate Similarity NPD2091 Phase 2
0.7887 Intermediate Similarity NPD2094 Phase 2
0.7887 Intermediate Similarity NPD2095 Phase 2
0.7887 Intermediate Similarity NPD2092 Phase 2
0.7826 Intermediate Similarity NPD7947 Clinical (unspecified phase)
0.776 Intermediate Similarity NPD482 Approved
0.772 Intermediate Similarity NPD749 Clinical (unspecified phase)
0.7696 Intermediate Similarity NPD4184 Clinical (unspecified phase)
0.7681 Intermediate Similarity NPD5426 Phase 3
0.7681 Intermediate Similarity NPD5901 Discontinued
0.7667 Intermediate Similarity NPD7998 Clinical (unspecified phase)
0.7638 Intermediate Similarity NPD8431 Approved
0.763 Intermediate Similarity NPD7470 Discontinued
0.761 Intermediate Similarity NPD7621 Clinical (unspecified phase)
0.7602 Intermediate Similarity NPD6595 Phase 3
0.759 Intermediate Similarity NPD2144 Approved
0.7576 Intermediate Similarity NPD3607 Clinical (unspecified phase)
0.7573 Intermediate Similarity NPD8248 Clinical (unspecified phase)
0.7571 Intermediate Similarity NPD2509 Approved
0.7571 Intermediate Similarity NPD2510 Approved
0.7563 Intermediate Similarity NPD3038 Discontinued
0.756 Intermediate Similarity NPD6732 Clinical (unspecified phase)
0.756 Intermediate Similarity NPD7958 Clinical (unspecified phase)
0.756 Intermediate Similarity NPD7957 Phase 1
0.7559 Intermediate Similarity NPD8094 Discontinued
0.7526 Intermediate Similarity NPD750 Phase 2
0.7524 Intermediate Similarity NPD7000 Clinical (unspecified phase)
0.7524 Intermediate Similarity NPD6999 Discontinued
0.7523 Intermediate Similarity NPD8112 Clinical (unspecified phase)
0.7512 Intermediate Similarity NPD8093 Discontinued
0.75 Intermediate Similarity NPD7809 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD7825 Clinical (unspecified phase)
0.7488 Intermediate Similarity NPD4600 Approved
0.7488 Intermediate Similarity NPD4601 Approved
0.7476 Intermediate Similarity NPD4862 Clinical (unspecified phase)
0.7476 Intermediate Similarity NPD7001 Phase 3
0.7465 Intermediate Similarity NPD8013 Clinical (unspecified phase)
0.7464 Intermediate Similarity NPD8072 Approved
0.7462 Intermediate Similarity NPD4076 Approved
0.7462 Intermediate Similarity NPD4079 Approved
0.7461 Intermediate Similarity NPD2844 Phase 3
0.7461 Intermediate Similarity NPD5069 Clinical (unspecified phase)
0.7441 Intermediate Similarity NPD6838 Clinical (unspecified phase)
0.7438 Intermediate Similarity NPD6630 Clinical (unspecified phase)
0.7429 Intermediate Similarity NPD8272 Phase 2
0.7426 Intermediate Similarity NPD8110 Clinical (unspecified phase)
0.7419 Intermediate Similarity NPD8405 Clinical (unspecified phase)
0.7416 Intermediate Similarity NPD5721 Clinical (unspecified phase)
0.7415 Intermediate Similarity NPD7944 Discontinued
0.7411 Intermediate Similarity NPD3506 Approved
0.7411 Intermediate Similarity NPD3505 Approved
0.7407 Intermediate Similarity NPD3389 Approved
0.7407 Intermediate Similarity NPD3394 Approved
0.7407 Intermediate Similarity NPD3393 Approved
0.7404 Intermediate Similarity NPD484 Approved
0.7398 Intermediate Similarity NPD5065 Approved
0.7381 Intermediate Similarity NPD2121 Clinical (unspecified phase)
0.7358 Intermediate Similarity NPD8493 Clinical (unspecified phase)
0.7346 Intermediate Similarity NPD8282 Approved
0.7346 Intermediate Similarity NPD56 Approved
0.7346 Intermediate Similarity NPD8283 Approved
0.7343 Intermediate Similarity NPD7948 Phase 1
0.7333 Intermediate Similarity NPD8073 Approved
0.7324 Intermediate Similarity NPD7665 Phase 2
0.7324 Intermediate Similarity NPD8423 Phase 2
0.7324 Intermediate Similarity NPD7666 Phase 3
0.7324 Intermediate Similarity NPD8399 Phase 1
0.7295 Intermediate Similarity NPD7818 Clinical (unspecified phase)
0.7277 Intermediate Similarity NPD6610 Clinical (unspecified phase)
0.7269 Intermediate Similarity NPD7594 Clinical (unspecified phase)
0.7268 Intermediate Similarity NPD6180 Clinical (unspecified phase)
0.7264 Intermediate Similarity NPD6987 Phase 1
0.726 Intermediate Similarity NPD5003 Discontinued
0.726 Intermediate Similarity NPD6664 Approved
0.7246 Intermediate Similarity NPD7619 Phase 3
0.7246 Intermediate Similarity NPD7618 Phase 3
0.7245 Intermediate Similarity NPD1325 Approved
0.7245 Intermediate Similarity NPD1326 Approved
0.7244 Intermediate Similarity NPD7824 Approved
0.7236 Intermediate Similarity NPD6203 Clinical (unspecified phase)
0.7206 Intermediate Similarity NPD3486 Clinical (unspecified phase)
0.7204 Intermediate Similarity NPD7903 Clinical (unspecified phase)
0.7195 Intermediate Similarity NPD6242 Discontinued
0.719 Intermediate Similarity NPD6661 Clinical (unspecified phase)
0.7186 Intermediate Similarity NPD6375 Clinical (unspecified phase)
0.7171 Intermediate Similarity NPD7233 Approved
0.7171 Intermediate Similarity NPD7234 Approved
0.7164 Intermediate Similarity NPD5897 Approved
0.7164 Intermediate Similarity NPD8464 Clinical (unspecified phase)
0.7164 Intermediate Similarity NPD5899 Approved
0.7164 Intermediate Similarity NPD5898 Approved
0.7157 Intermediate Similarity NPD4426 Clinical (unspecified phase)
0.7156 Intermediate Similarity NPD7730 Approved
0.7156 Intermediate Similarity NPD7731 Approved
0.7156 Intermediate Similarity NPD6164 Phase 2
0.7156 Intermediate Similarity NPD6165 Phase 2
0.7149 Intermediate Similarity NPD7791 Approved
0.7149 Intermediate Similarity NPD7950 Approved
0.7149 Intermediate Similarity NPD7789 Approved
0.7149 Intermediate Similarity NPD7953 Approved
0.7149 Intermediate Similarity NPD7951 Approved
0.7149 Intermediate Similarity NPD7952 Approved
0.7149 Intermediate Similarity NPD7790 Approved
0.7143 Intermediate Similarity NPD7777 Approved
0.7143 Intermediate Similarity NPD53 Approved
0.7143 Intermediate Similarity NPD7778 Approved
0.7136 Intermediate Similarity NPD3871 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD4499 Approved
0.7136 Intermediate Similarity NPD4736 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD2565 Phase 2
0.7136 Intermediate Similarity NPD8000 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD2564 Approved
0.7136 Intermediate Similarity NPD8406 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD3870 Clinical (unspecified phase)
0.7129 Intermediate Similarity NPD3178 Discontinued
0.7115 Intermediate Similarity NPD5575 Clinical (unspecified phase)
0.7114 Intermediate Similarity NPD8386 Phase 2
0.711 Intermediate Similarity NPD4852 Phase 2
0.7105 Intermediate Similarity NPD2172 Phase 1
0.7105 Intermediate Similarity NPD4463 Approved
0.7105 Intermediate Similarity NPD4462 Approved
0.7103 Intermediate Similarity NPD8098 Approved
0.7101 Intermediate Similarity NPD2336 Approved
0.71 Intermediate Similarity NPD4075 Phase 2
0.7092 Intermediate Similarity NPD5744 Clinical (unspecified phase)
0.7081 Intermediate Similarity NPD786 Approved
0.7067 Intermediate Similarity NPD7271 Approved
0.7059 Intermediate Similarity NPD8327 Clinical (unspecified phase)
0.7059 Intermediate Similarity NPD8325 Phase 3
0.7059 Intermediate Similarity NPD8326 Phase 3
0.7033 Intermediate Similarity NPD1038 Approved
0.7027 Intermediate Similarity NPD7878 Phase 2
0.7023 Intermediate Similarity NPD3947 Discontinued
0.702 Intermediate Similarity NPD4639 Approved
0.702 Intermediate Similarity NPD4640 Approved
0.702 Intermediate Similarity NPD4638 Approved
0.7019 Intermediate Similarity NPD5592 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD4051 Discontinued
0.7015 Intermediate Similarity NPD5100 Phase 3
0.701 Intermediate Similarity NPD5596 Phase 2
0.7009 Intermediate Similarity NPD7187 Phase 2
0.7005 Intermediate Similarity NPD1592 Phase 3
0.7005 Intermediate Similarity NPD1722 Approved
0.7 Intermediate Similarity NPD4427 Phase 2
0.6995 Remote Similarity NPD4501 Approved
0.6995 Remote Similarity NPD4500 Approved
0.6995 Remote Similarity NPD5473 Discontinued
0.6986 Remote Similarity NPD4614 Clinical (unspecified phase)
0.6986 Remote Similarity NPD7927 Clinical (unspecified phase)
0.6986 Remote Similarity NPD6665 Discontinued
0.698 Remote Similarity NPD4181 Approved
0.6977 Remote Similarity NPD2920 Discontinued
0.6977 Remote Similarity NPD6176 Phase 1
0.6967 Remote Similarity NPD2307 Discontinued
0.6963 Remote Similarity NPD3100 Discontinued
0.696 Remote Similarity NPD7603 Discontinued
0.6957 Remote Similarity NPD3961 Discontinued
0.6957 Remote Similarity NPD4948 Discontinued
0.6955 Remote Similarity NPD8096 Phase 3
0.6955 Remote Similarity NPD8097 Phase 3
0.6954 Remote Similarity NPD5140 Approved
0.6954 Remote Similarity NPD5088 Discontinued
0.6954 Remote Similarity NPD3323 Discontinued
0.6954 Remote Similarity NPD5138 Approved
0.6952 Remote Similarity NPD802 Phase 2
0.6944 Remote Similarity NPD7712 Clinical (unspecified phase)
0.6944 Remote Similarity NPD8115 Approved
0.6944 Remote Similarity NPD8114 Approved
0.6939 Remote Similarity NPD2511 Approved
0.6926 Remote Similarity NPD5040 Clinical (unspecified phase)
0.6919 Remote Similarity NPD5975 Clinical (unspecified phase)
0.6919 Remote Similarity NPD1568 Clinical (unspecified phase)
0.6919 Remote Similarity NPD198 Clinical (unspecified phase)
0.6916 Remote Similarity NPD7269 Clinical (unspecified phase)
0.6916 Remote Similarity NPD6479 Discontinued
0.6913 Remote Similarity NPD8372 Clinical (unspecified phase)
0.6912 Remote Similarity NPD2481 Approved
0.6912 Remote Similarity NPD2479 Phase 3
0.6911 Remote Similarity NPD4703 Approved
0.6911 Remote Similarity NPD4702 Approved
0.6903 Remote Similarity NPD6995 Phase 1
0.6901 Remote Similarity NPD7946 Pre-registration
0.69 Remote Similarity NPD7780 Approved
0.69 Remote Similarity NPD7781 Approved
0.6897 Remote Similarity NPD8123 Approved
0.6897 Remote Similarity NPD8122 Approved
0.6893 Remote Similarity NPD6178 Phase 3
0.6893 Remote Similarity NPD7564 Discontinued
0.6892 Remote Similarity NPD7970 Approved
0.6892 Remote Similarity NPD7707 Approved
0.6892 Remote Similarity NPD7971 Clinical (unspecified phase)
0.6886 Remote Similarity NPD7711 Discontinued
0.6886 Remote Similarity NPD8289 Discontinued
0.6881 Remote Similarity NPD8322 Phase 2
0.6881 Remote Similarity NPD4128 Approved
0.6872 Remote Similarity NPD1304 Clinical (unspecified phase)
0.6872 Remote Similarity NPD276 Clinical (unspecified phase)
0.6866 Remote Similarity NPD6323 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   46209920
ChEMBL   CHEMBL1097909
ZINC  

Physicochemical Properties

Molecular Weight:  528.26
ALogP:  -0.3242
MLogP:  4.21
XLogP:  3.646
# Rotatable Bonds:  8
Polar Surface Area:  119.82
# H-Bond Aceptor:  7
# H-Bond Donor:  3
# Rings:  5
# Heavy Atoms:  39

Download Data

Data Type Select
General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs