Natural Product: NPC234497

Natural Product ID:  NPC234497
Common Name:   Alterporriol A/B
IUPAC Name:   4,6-dihydroxy-2-methoxy-7-methyl-1-[(5S,6R,7S,8R)-4,5,6,7,8-pentahydroxy-2-methoxy-7-methyl-9,10-dioxo-6,8-dihydro-5H-anthracen-1-yl]anthracene-9,10-dione
Synonyms:   Alterporriol A/B
Molecular Formula:   C32H26O13
Standard InCHIKey:  YHXUFRJJYFYRSH-BVEPWEIPSA-N
Standard InCHI:  InChI=1S/C32H26O13/c1-9-5-10-11(6-12(9)33)25(36)17-13(34)7-15(44-3)19(21(17)26(10)37)20-16(45-4)8-14(35)18-22(20)28(39)24-23(27(18)38)29(40)31(42)32(2,43)30(24)41/h5-8,29-31,33-35,40-43H,1-4H3/t29-,30+,31+,32-/m0/s1
Canonical SMILES:  COc1cc(O)c2c(c1c1c(OC)cc(c3c1C(=O)c1cc(C)c(cc1C3=O)O)O)C(=O)C1=C(C2=O)[C@H](O)[C@H]([C@@]([C@@H]1O)(C)O)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
NPO16860 Stemphylium globuliferum Species Pleosporaceae Eukaryota Mentha pulegium PMID[19271717]
NPO33215 Stemphylium sp. 33231 Species Pleosporaceae Eukaryota South China Sea PMID[25136754]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified IC50 > 10000 nM 22583079
NPT2 Others Unspecified IC50 > 10000 nM 21428459
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC > 10000 nM 12027740
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 10000 nM 19053514
NPT1238 Organism Staphylococcus Staphylococcus MIC > 10000 nM 24742384
NPT1238 Organism Staphylococcus Staphylococcus MIC > 10000 nM 10.6019/CHEMBL1201861
NPT1864 Cell Line L5178Y Mus musculus Activity = 31.1 % 22939698
NPT81 Cell Line A549 Homo sapiens IC50 > 10000 nM 8158155
NPT314 Organism Bacillus cereus Bacillus cereus MIC > 10000 nM 15332869
NPT314 Organism Bacillus cereus Bacillus cereus MIC = 7900 nM 18183025
NPT19 Organism Escherichia coli Escherichia coli MIC > 10000 nM 18183025
NPT3146 Organism Micrococcus Micrococcus MIC > 10000 nM 15730253
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 10000 nM 17938185
NPT19 Organism Escherichia coli Escherichia coli MIC > 10000 nM 18955522
NPT3147 Organism Kocuria rhizophila Kocuria rhizophila MIC > 10000 nM PubChem BioAssay data set
NPT3147 Organism Kocuria rhizophila Kocuria rhizophila MIC > 10000 nM 12398531
NPT81 Cell Line A549 Homo sapiens IC50 > 10000 nM 25856683
NPT3146 Organism Micrococcus Micrococcus MIC > 10000 nM 8864235
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC > 10000 nM 11575968

  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 NPC234497 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 NPC472058
1.0 High Similarity NPC324522
1.0 High Similarity NPC470341
1.0 High Similarity NPC105414
0.9691 High Similarity NPC477991
0.9691 High Similarity NPC477992
0.9623 High Similarity NPC472057
0.9623 High Similarity NPC472051
0.9497 High Similarity NPC472059
0.9437 High Similarity NPC472053
0.943 High Similarity NPC324736
0.9371 High Similarity NPC470342
0.9371 High Similarity NPC472052
0.9371 High Similarity NPC472060
0.9299 High Similarity NPC155686
0.9241 High Similarity NPC226656
0.9241 High Similarity NPC66508
0.9193 High Similarity NPC472261
0.9172 High Similarity NPC46882
0.9172 High Similarity NPC132990
0.9172 High Similarity NPC470569
0.9141 High Similarity NPC469664
0.9114 High Similarity NPC470340
0.9108 High Similarity NPC470568
0.9108 High Similarity NPC147735
0.9096 High Similarity NPC477836
0.9085 High Similarity NPC477835
0.9085 High Similarity NPC178173
0.9053 High Similarity NPC277710
0.9053 High Similarity NPC299149
0.9053 High Similarity NPC153578
0.9053 High Similarity NPC114257
0.9042 High Similarity NPC154986
0.9012 High Similarity NPC284495
0.9 High Similarity NPC68727
0.8994 High Similarity NPC268992
0.8994 High Similarity NPC51824
0.8994 High Similarity NPC470338
0.8994 High Similarity NPC180944
0.8994 High Similarity NPC113608
0.8994 High Similarity NPC470337
0.8987 High Similarity NPC255641
0.8987 High Similarity NPC290954
0.8957 High Similarity NPC273467
0.8957 High Similarity NPC219686
0.8957 High Similarity NPC189552
0.8953 High Similarity NPC87583
0.8951 High Similarity NPC228654
0.8917 High Similarity NPC34802
0.8917 High Similarity NPC190648
0.8917 High Similarity NPC312929
0.8917 High Similarity NPC126767
0.8917 High Similarity NPC245584
0.8917 High Similarity NPC289042
0.8917 High Similarity NPC56433
0.8917 High Similarity NPC118027
0.8902 High Similarity NPC15374
0.8896 High Similarity NPC470810
0.8896 High Similarity NPC312993
0.8896 High Similarity NPC186325
0.8889 High Similarity NPC315221
0.8882 High Similarity NPC470334
0.8882 High Similarity NPC477682
0.8882 High Similarity NPC477683
0.8875 High Similarity NPC40356
0.8875 High Similarity NPC154683
0.8869 High Similarity NPC271385
0.8869 High Similarity NPC30432
0.8869 High Similarity NPC473113
0.8869 High Similarity NPC76128
0.8869 High Similarity NPC5029
0.8869 High Similarity NPC111536
0.8868 High Similarity NPC294646
0.8868 High Similarity NPC225854
0.8862 High Similarity NPC264063
0.8862 High Similarity NPC469486
0.8841 High Similarity NPC18380
0.8841 High Similarity NPC137232
0.8837 High Similarity NPC313452
0.8834 High Similarity NPC177650
0.8827 High Similarity NPC472050
0.8824 High Similarity NPC475233
0.8824 High Similarity NPC475246
0.8824 High Similarity NPC46958
0.882 High Similarity NPC107109
0.8817 High Similarity NPC85368
0.8817 High Similarity NPC470336
0.8817 High Similarity NPC470335
0.8817 High Similarity NPC470333
0.8817 High Similarity NPC472054
0.8817 High Similarity NPC469393
0.8817 High Similarity NPC98776
0.8812 High Similarity NPC149526
0.8812 High Similarity NPC474417
0.8805 High Similarity NPC329933
0.8802 High Similarity NPC76647
0.8795 High Similarity NPC26386
0.8795 High Similarity NPC472049
0.879 High Similarity NPC34482
0.878 High Similarity NPC292863
0.878 High Similarity NPC476506
0.878 High Similarity NPC184326
0.878 High Similarity NPC472055
0.8779 High Similarity NPC208069
0.8773 High Similarity NPC474637
0.8773 High Similarity NPC199463
0.8773 High Similarity NPC37543
0.8765 High Similarity NPC68381
0.8765 High Similarity NPC3718
0.8758 High Similarity NPC43345
0.875 High Similarity NPC54903
0.875 High Similarity NPC300307
0.875 High Similarity NPC286074
0.875 High Similarity NPC477914
0.8743 High Similarity NPC251336
0.8743 High Similarity NPC469394
0.8735 High Similarity NPC290160
0.8734 High Similarity NPC470570
0.8726 High Similarity NPC244691
0.8726 High Similarity NPC48762
0.8726 High Similarity NPC19896
0.872 High Similarity NPC18699
0.872 High Similarity NPC55443
0.872 High Similarity NPC51760
0.872 High Similarity NPC195167
0.872 High Similarity NPC470339
0.872 High Similarity NPC105584
0.8712 High Similarity NPC77807
0.8712 High Similarity NPC5379
0.8712 High Similarity NPC478223
0.8712 High Similarity NPC208152
0.8712 High Similarity NPC78492
0.8712 High Similarity NPC14561
0.8706 High Similarity NPC229051
0.8706 High Similarity NPC131862
0.8704 High Similarity NPC329844
0.8704 High Similarity NPC93552
0.8704 High Similarity NPC208806
0.8696 High Similarity NPC476551
0.8696 High Similarity NPC72958
0.8696 High Similarity NPC476552
0.8696 High Similarity NPC232645
0.8696 High Similarity NPC478148
0.8696 High Similarity NPC476553
0.869 High Similarity NPC474024
0.869 High Similarity NPC473094
0.869 High Similarity NPC253730
0.869 High Similarity NPC286230
0.8688 High Similarity NPC477221
0.8686 High Similarity NPC105591
0.8683 High Similarity NPC169471
0.8683 High Similarity NPC478020
0.8683 High Similarity NPC478022
0.8679 High Similarity NPC37709
0.8679 High Similarity NPC290194
0.8679 High Similarity NPC51070
0.8679 High Similarity NPC222298
0.8675 High Similarity NPC478229
0.8675 High Similarity NPC473961
0.8675 High Similarity NPC149389
0.8671 High Similarity NPC478019
0.8671 High Similarity NPC475161
0.8671 High Similarity NPC477860
0.8671 High Similarity NPC49282
0.8667 High Similarity NPC472618
0.8667 High Similarity NPC195136
0.8667 High Similarity NPC84571
0.8662 High Similarity NPC167663
0.8662 High Similarity NPC84266
0.8659 High Similarity NPC263483
0.8659 High Similarity NPC208258
0.8659 High Similarity NPC178976
0.865 High Similarity NPC79375
0.865 High Similarity NPC66029
0.865 High Similarity NPC37253
0.8647 High Similarity NPC4200
0.8642 High Similarity NPC87708
0.8639 High Similarity NPC259905
0.8639 High Similarity NPC473095
0.8639 High Similarity NPC473096
0.8639 High Similarity NPC53252
0.8639 High Similarity NPC222455
0.8639 High Similarity NPC188079
0.8634 High Similarity NPC205766
0.8634 High Similarity NPC202595
0.8634 High Similarity NPC280295
0.8631 High Similarity NPC85047
0.8631 High Similarity NPC120857
0.8631 High Similarity NPC178851
0.8631 High Similarity NPC17274
0.8631 High Similarity NPC30027
0.8625 High Similarity NPC172329
0.8625 High Similarity NPC472841
0.8625 High Similarity NPC2569
0.8623 High Similarity NPC473009
0.8623 High Similarity NPC100849
0.8621 High Similarity NPC293227
0.8621 High Similarity NPC475662
0.8621 High Similarity NPC478001
0.8621 High Similarity NPC473717

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC234497 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
0.8957 High Similarity NPD6959 Discontinued
0.8675 High Similarity NPD6232 Discontinued
0.8631 High Similarity NPD7473 Discontinued
0.8519 High Similarity NPD4380 Phase 2
0.8491 Intermediate Similarity NPD7390 Discontinued
0.8475 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.8362 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.8313 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.8253 Intermediate Similarity NPD7819 Suspended
0.8253 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8246 Intermediate Similarity NPD6166 Phase 2
0.8246 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8246 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.8246 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.8217 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.821 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.8208 Intermediate Similarity NPD5844 Phase 1
0.8191 Intermediate Similarity NPD8151 Discontinued
0.8098 Intermediate Similarity NPD2534 Approved
0.8098 Intermediate Similarity NPD2533 Approved
0.8098 Intermediate Similarity NPD2532 Approved
0.8079 Intermediate Similarity NPD8312 Approved
0.8079 Intermediate Similarity NPD8313 Approved
0.8068 Intermediate Similarity NPD6559 Discontinued
0.8054 Intermediate Similarity NPD6778 Approved
0.8054 Intermediate Similarity NPD6780 Approved
0.8054 Intermediate Similarity NPD6777 Approved
0.8054 Intermediate Similarity NPD6779 Approved
0.8054 Intermediate Similarity NPD6776 Approved
0.8054 Intermediate Similarity NPD6781 Approved
0.8054 Intermediate Similarity NPD6782 Approved
0.8047 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.8047 Intermediate Similarity NPD7768 Phase 2
0.8045 Intermediate Similarity NPD8150 Discontinued
0.8024 Intermediate Similarity NPD7411 Suspended
0.8011 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD7075 Discontinued
0.7988 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7987 Intermediate Similarity NPD1510 Phase 2
0.7979 Intermediate Similarity NPD7871 Phase 2
0.7979 Intermediate Similarity NPD7870 Phase 2
0.7976 Intermediate Similarity NPD1934 Approved
0.7975 Intermediate Similarity NPD1607 Approved
0.7926 Intermediate Similarity NPD7697 Approved
0.7926 Intermediate Similarity NPD7696 Phase 3
0.7926 Intermediate Similarity NPD7435 Discontinued
0.7926 Intermediate Similarity NPD7698 Approved
0.7904 Intermediate Similarity NPD3226 Approved
0.7895 Intermediate Similarity NPD3749 Approved
0.7879 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.787 Intermediate Similarity NPD6801 Discontinued
0.7853 Intermediate Similarity NPD7074 Phase 3
0.7853 Intermediate Similarity NPD7701 Phase 2
0.7848 Intermediate Similarity NPD1240 Approved
0.7841 Intermediate Similarity NPD3818 Discontinued
0.7841 Intermediate Similarity NPD3751 Discontinued
0.784 Intermediate Similarity NPD1549 Phase 2
0.7824 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7824 Intermediate Similarity NPD2801 Approved
0.7803 Intermediate Similarity NPD5494 Approved
0.7797 Intermediate Similarity NPD7054 Approved
0.7784 Intermediate Similarity NPD6535 Approved
0.7784 Intermediate Similarity NPD6534 Approved
0.7778 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7772 Intermediate Similarity NPD7874 Approved
0.7772 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7754 Intermediate Similarity NPD7700 Phase 2
0.7754 Intermediate Similarity NPD7699 Phase 2
0.7753 Intermediate Similarity NPD7472 Approved
0.7733 Intermediate Similarity NPD3882 Suspended
0.7732 Intermediate Similarity NPD7801 Approved
0.773 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7722 Intermediate Similarity NPD7808 Phase 3
0.7716 Intermediate Similarity NPD5406 Approved
0.7716 Intermediate Similarity NPD2796 Approved
0.7716 Intermediate Similarity NPD5404 Approved
0.7716 Intermediate Similarity NPD5408 Approved
0.7716 Intermediate Similarity NPD5405 Approved
0.7711 Intermediate Similarity NPD1511 Approved
0.7709 Intermediate Similarity NPD6797 Phase 2
0.7684 Intermediate Similarity NPD6823 Phase 2
0.7674 Intermediate Similarity NPD5402 Approved
0.7667 Intermediate Similarity NPD7251 Discontinued
0.7647 Intermediate Similarity NPD6599 Discontinued
0.7641 Intermediate Similarity NPD7783 Phase 2
0.7641 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7636 Intermediate Similarity NPD3750 Approved
0.7636 Intermediate Similarity NPD7003 Approved
0.7619 Intermediate Similarity NPD1512 Approved
0.7616 Intermediate Similarity NPD1465 Phase 2
0.7614 Intermediate Similarity NPD3787 Discontinued
0.7607 Intermediate Similarity NPD2935 Discontinued
0.7604 Intermediate Similarity NPD8319 Approved
0.7604 Intermediate Similarity NPD8320 Phase 1
0.7588 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7576 Intermediate Similarity NPD2800 Approved
0.7572 Intermediate Similarity NPD3817 Phase 2
0.7558 Intermediate Similarity NPD37 Approved
0.7531 Intermediate Similarity NPD6651 Approved
0.7527 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7514 Intermediate Similarity NPD5711 Approved
0.7514 Intermediate Similarity NPD5710 Approved
0.75 Intermediate Similarity NPD6799 Approved
0.7485 Intermediate Similarity NPD7458 Discontinued
0.7475 Intermediate Similarity NPD8155 Clinical (unspecified phase)
0.7471 Intermediate Similarity NPD5403 Approved
0.747 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7459 Intermediate Similarity NPD8434 Phase 2
0.7455 Intermediate Similarity NPD2346 Discontinued
0.7447 Intermediate Similarity NPD6213 Phase 3
0.7447 Intermediate Similarity NPD6212 Phase 3
0.7447 Intermediate Similarity NPD6214 Clinical (unspecified phase)
0.7444 Intermediate Similarity NPD7228 Approved
0.7443 Intermediate Similarity NPD6234 Discontinued
0.7429 Intermediate Similarity NPD4965 Approved
0.7429 Intermediate Similarity NPD4967 Phase 2
0.7429 Intermediate Similarity NPD4966 Approved
0.7425 Intermediate Similarity NPD4628 Phase 3
0.7425 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7407 Intermediate Similarity NPD943 Approved
0.7405 Intermediate Similarity NPD1470 Approved
0.7405 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7394 Intermediate Similarity NPD6100 Approved
0.7394 Intermediate Similarity NPD6099 Approved
0.7374 Intermediate Similarity NPD3926 Phase 2
0.7353 Intermediate Similarity NPD5401 Approved
0.7353 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD2344 Approved
0.7333 Intermediate Similarity NPD3748 Approved
0.733 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7322 Intermediate Similarity NPD5953 Discontinued
0.7321 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7314 Intermediate Similarity NPD8455 Phase 2
0.7289 Intermediate Similarity NPD1551 Phase 2
0.7267 Intermediate Similarity NPD920 Approved
0.7267 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7253 Intermediate Similarity NPD7177 Discontinued
0.7229 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD7229 Phase 3
0.7222 Intermediate Similarity NPD4625 Phase 3
0.7212 Intermediate Similarity NPD8058 Clinical (unspecified phase)
0.7212 Intermediate Similarity NPD8059 Phase 3
0.7208 Intermediate Similarity NPD7211 Clinical (unspecified phase)
0.7178 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7176 Intermediate Similarity NPD2309 Approved
0.7167 Intermediate Similarity NPD7199 Phase 2
0.7167 Intermediate Similarity NPD1247 Approved
0.7165 Intermediate Similarity NPD8285 Discontinued
0.716 Intermediate Similarity NPD1243 Approved
0.7152 Intermediate Similarity NPD230 Phase 1
0.7152 Intermediate Similarity NPD1201 Approved
0.7151 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7151 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7128 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7126 Intermediate Similarity NPD2799 Discontinued
0.712 Intermediate Similarity NPD7286 Phase 2
0.711 Intermediate Similarity NPD6273 Approved
0.7097 Intermediate Similarity NPD7240 Approved
0.7095 Intermediate Similarity NPD7654 Discontinued
0.7076 Intermediate Similarity NPD6190 Approved
0.7073 Intermediate Similarity NPD3764 Approved
0.7065 Intermediate Similarity NPD7893 Clinical (unspecified phase)
0.7056 Intermediate Similarity NPD919 Approved
0.7055 Intermediate Similarity NPD4908 Phase 1
0.7047 Intermediate Similarity NPD4360 Phase 2
0.7047 Intermediate Similarity NPD4363 Phase 3
0.7035 Intermediate Similarity NPD3300 Phase 2
0.7035 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7022 Intermediate Similarity NPD5760 Phase 2
0.7022 Intermediate Similarity NPD5761 Phase 2
0.7018 Intermediate Similarity NPD8166 Discontinued
0.7016 Intermediate Similarity NPD4287 Approved
0.7012 Intermediate Similarity NPD3027 Phase 3
0.7005 Intermediate Similarity NPD7685 Pre-registration
0.7 Intermediate Similarity NPD7584 Approved
0.6995 Remote Similarity NPD7184 Clinical (unspecified phase)
0.697 Remote Similarity NPD2313 Discontinued
0.697 Remote Similarity NPD6859 Clinical (unspecified phase)
0.697 Remote Similarity NPD6410 Clinical (unspecified phase)
0.6962 Remote Similarity NPD1651 Approved
0.6959 Remote Similarity NPD5698 Clinical (unspecified phase)
0.6933 Remote Similarity NPD2798 Approved
0.6933 Remote Similarity NPD6917 Clinical (unspecified phase)
0.6914 Remote Similarity NPD1283 Approved
0.6894 Remote Similarity NPD3972 Approved
0.6886 Remote Similarity NPD1613 Approved
0.6886 Remote Similarity NPD1612 Clinical (unspecified phase)
0.6885 Remote Similarity NPD8127 Discontinued
0.6882 Remote Similarity NPD2438 Suspended
0.6852 Remote Similarity NPD4749 Approved
0.6845 Remote Similarity NPD7930 Approved
0.6842 Remote Similarity NPD2343 Clinical (unspecified phase)
0.6842 Remote Similarity NPD1471 Phase 3
0.6832 Remote Similarity NPD6973 Clinical (unspecified phase)
0.6824 Remote Similarity NPD7033 Discontinued
0.681 Remote Similarity NPD7907 Approved
0.68 Remote Similarity NPD6143 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   163910
ChEMBL   CHEMBL552546
ZINC  

Physicochemical Properties

Molecular Weight:  618.14
ALogP:  -3.6589
MLogP:  3.55
XLogP:  -1.085
# Rotatable Bonds:  14
Polar Surface Area:  228.35
# H-Bond Aceptor:  8
# H-Bond Donor:  7
# Rings:  6
# Heavy Atoms:  45

Download Data

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Biological Activities  
Similar NPs/Drugs