Natural Product: NPC476999

Natural Product ID:  NPC476999
Common Name:   n.a.
IUPAC Name:  
Synonyms:   Lamellarin C-Diacetate
Molecular Formula:   C34H33NO10
Standard InCHIKey:  MQCSKLLUQRBKBR-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C34H33NO10/c1-17(36)44-24-9-8-19(12-26(24)38-3)30-31-22-14-27(39-4)28(45-18(2)37)15-25(22)43-16-23(31)35-11-10-20-21(32(30)35)13-29(40-5)34(42-7)33(20)41-6/h8-9,12-15H,10-11,16H2,1-7H3
Canonical SMILES:  COc1cc(ccc1OC(=O)C)c1c2c3cc(OC)c(c(c3CCn2c2c1c1cc(OC)c(cc1OC2)OC(=O)C)OC)OC
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
NPO16570 Didemnum obscurum Species Didemnidae Eukaryota Tiruchandur coast in the Gulf of Mannar, Tamilnadu, India 2002-FEB PMID[15270574]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1 Others Radical scavenging activity Activity = 0 % 15270574
NPT1 Others Radical scavenging activity Activity = 30.95 % 15270574
NPT1 Others Radical scavenging activity Activity = 61.9 % 15270574
NPT1 Others Radical scavenging activity Activity = 92.84 % 15270574
NPT1 Others Radical scavenging activity IC50 = 5870000 nM 15270574
NPT2 Others Unspecified Ratio IC50 = 0.01 15270574

  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 NPC476999 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
0.9573 High Similarity NPC476995
0.9289 High Similarity NPC476996
0.9289 High Similarity NPC476998
0.9242 High Similarity NPC476994
0.9242 High Similarity NPC476997
0.8609 High Similarity NPC318068
0.8534 High Similarity NPC129897
0.8142 Intermediate Similarity NPC255800
0.8142 Intermediate Similarity NPC96584
0.8133 Intermediate Similarity NPC201508
0.8056 Intermediate Similarity NPC290689
0.7934 Intermediate Similarity NPC31930
0.7917 Intermediate Similarity NPC284685
0.7907 Intermediate Similarity NPC476581
0.7907 Intermediate Similarity NPC16452
0.7907 Intermediate Similarity NPC36229
0.79 Intermediate Similarity NPC296482
0.79 Intermediate Similarity NPC53069
0.79 Intermediate Similarity NPC202768
0.7884 Intermediate Similarity NPC191489
0.784 Intermediate Similarity NPC476582
0.784 Intermediate Similarity NPC4071
0.784 Intermediate Similarity NPC476578
0.7834 Intermediate Similarity NPC313189
0.7812 Intermediate Similarity NPC174049
0.7803 Intermediate Similarity NPC473822
0.7755 Intermediate Similarity NPC88923
0.7755 Intermediate Similarity NPC315634
0.7755 Intermediate Similarity NPC100734
0.7738 Intermediate Similarity NPC171409
0.7738 Intermediate Similarity NPC96405
0.7723 Intermediate Similarity NPC23614
0.7723 Intermediate Similarity NPC100079
0.7703 Intermediate Similarity NPC149471
0.7703 Intermediate Similarity NPC271215
0.7689 Intermediate Similarity NPC148409
0.7671 Intermediate Similarity NPC135549
0.7665 Intermediate Similarity NPC122463
0.7661 Intermediate Similarity NPC164374
0.7661 Intermediate Similarity NPC137929
0.7658 Intermediate Similarity NPC202605
0.7658 Intermediate Similarity NPC112206
0.7647 Intermediate Similarity NPC219664
0.7642 Intermediate Similarity NPC133140
0.7642 Intermediate Similarity NPC195268
0.7639 Intermediate Similarity NPC477019
0.7619 Intermediate Similarity NPC249996
0.7611 Intermediate Similarity NPC46451
0.7608 Intermediate Similarity NPC476202
0.7589 Intermediate Similarity NPC235076
0.7578 Intermediate Similarity NPC203168
0.7568 Intermediate Similarity NPC188420
0.7565 Intermediate Similarity NPC200888
0.756 Intermediate Similarity NPC195538
0.7553 Intermediate Similarity NPC119134
0.7545 Intermediate Similarity NPC474594
0.7534 Intermediate Similarity NPC469440
0.7531 Intermediate Similarity NPC284141
0.75 Intermediate Similarity NPC251160
0.7479 Intermediate Similarity NPC217554
0.7479 Intermediate Similarity NPC49672
0.7477 Intermediate Similarity NPC234197
0.7468 Intermediate Similarity NPC469792
0.7458 Intermediate Similarity NPC124313
0.7432 Intermediate Similarity NPC474595
0.743 Intermediate Similarity NPC469390
0.7424 Intermediate Similarity NPC54066
0.7416 Intermediate Similarity NPC293093
0.7415 Intermediate Similarity NPC90875
0.7409 Intermediate Similarity NPC66815
0.7404 Intermediate Similarity NPC233334
0.7395 Intermediate Similarity NPC11408
0.7375 Intermediate Similarity NPC207283
0.7375 Intermediate Similarity NPC84164
0.7373 Intermediate Similarity NPC329631
0.7362 Intermediate Similarity NPC475253
0.7359 Intermediate Similarity NPC280272
0.7359 Intermediate Similarity NPC118121
0.7336 Intermediate Similarity NPC204446
0.7327 Intermediate Similarity NPC85381
0.7318 Intermediate Similarity NPC11017
0.7315 Intermediate Similarity NPC41122
0.7315 Intermediate Similarity NPC318805
0.7309 Intermediate Similarity NPC472111
0.7308 Intermediate Similarity NPC312872
0.7306 Intermediate Similarity NPC183537
0.7277 Intermediate Similarity NPC299990
0.7277 Intermediate Similarity NPC73492
0.7273 Intermediate Similarity NPC10908
0.7273 Intermediate Similarity NPC227060
0.7273 Intermediate Similarity NPC477533
0.7273 Intermediate Similarity NPC276890
0.7273 Intermediate Similarity NPC76682
0.7273 Intermediate Similarity NPC317439
0.7273 Intermediate Similarity NPC63646
0.7273 Intermediate Similarity NPC198498
0.7273 Intermediate Similarity NPC115284
0.7273 Intermediate Similarity NPC317145
0.7269 Intermediate Similarity NPC277351
0.7265 Intermediate Similarity NPC203373
0.726 Intermediate Similarity NPC234318
0.7256 Intermediate Similarity NPC14507
0.7256 Intermediate Similarity NPC47077
0.7246 Intermediate Similarity NPC24019
0.7244 Intermediate Similarity NPC470931
0.7243 Intermediate Similarity NPC61350
0.7243 Intermediate Similarity NPC204385
0.7238 Intermediate Similarity NPC129518
0.7238 Intermediate Similarity NPC108342
0.7238 Intermediate Similarity NPC251580
0.7238 Intermediate Similarity NPC41376
0.7238 Intermediate Similarity NPC12424
0.7235 Intermediate Similarity NPC114335
0.7235 Intermediate Similarity NPC141915
0.7235 Intermediate Similarity NPC475597
0.7235 Intermediate Similarity NPC473716
0.7235 Intermediate Similarity NPC280964
0.7233 Intermediate Similarity NPC470042
0.7232 Intermediate Similarity NPC304183
0.7217 Intermediate Similarity NPC206201
0.7208 Intermediate Similarity NPC473183
0.7208 Intermediate Similarity NPC182907
0.7208 Intermediate Similarity NPC189903
0.7202 Intermediate Similarity NPC15406
0.7202 Intermediate Similarity NPC475190
0.7202 Intermediate Similarity NPC279401
0.7202 Intermediate Similarity NPC79293
0.7193 Intermediate Similarity NPC472098
0.7178 Intermediate Similarity NPC166722
0.7176 Intermediate Similarity NPC116465
0.7176 Intermediate Similarity NPC212237
0.7167 Intermediate Similarity NPC295228
0.7166 Intermediate Similarity NPC302807
0.7166 Intermediate Similarity NPC77878
0.7163 Intermediate Similarity NPC302275
0.7162 Intermediate Similarity NPC236668
0.7149 Intermediate Similarity NPC127085
0.7143 Intermediate Similarity NPC107123
0.7137 Intermediate Similarity NPC469589
0.713 Intermediate Similarity NPC95426
0.713 Intermediate Similarity NPC146976
0.713 Intermediate Similarity NPC16357
0.713 Intermediate Similarity NPC302245
0.7125 Intermediate Similarity NPC473184
0.7124 Intermediate Similarity NPC469439
0.712 Intermediate Similarity NPC472589
0.7118 Intermediate Similarity NPC94157
0.7116 Intermediate Similarity NPC30779
0.711 Intermediate Similarity NPC281581
0.7104 Intermediate Similarity NPC224928
0.7103 Intermediate Similarity NPC243454
0.7103 Intermediate Similarity NPC475479
0.7098 Intermediate Similarity NPC473660
0.7097 Intermediate Similarity NPC139783
0.7097 Intermediate Similarity NPC65312
0.7083 Intermediate Similarity NPC22481
0.707 Intermediate Similarity NPC286119
0.707 Intermediate Similarity NPC239584
0.7066 Intermediate Similarity NPC471303
0.7064 Intermediate Similarity NPC275680
0.7064 Intermediate Similarity NPC22115
0.7064 Intermediate Similarity NPC210434
0.7056 Intermediate Similarity NPC134637
0.7054 Intermediate Similarity NPC34770
0.7052 Intermediate Similarity NPC120513
0.7051 Intermediate Similarity NPC132642
0.7051 Intermediate Similarity NPC472099
0.7049 Intermediate Similarity NPC99891
0.7049 Intermediate Similarity NPC210296
0.7045 Intermediate Similarity NPC24260
0.7045 Intermediate Similarity NPC302001
0.704 Intermediate Similarity NPC472588
0.7037 Intermediate Similarity NPC90998
0.7037 Intermediate Similarity NPC8836
0.7037 Intermediate Similarity NPC217748
0.7037 Intermediate Similarity NPC7715
0.7037 Intermediate Similarity NPC182052
0.7037 Intermediate Similarity NPC285931
0.7037 Intermediate Similarity NPC222661
0.7037 Intermediate Similarity NPC290005
0.7037 Intermediate Similarity NPC54654
0.7037 Intermediate Similarity NPC15414
0.7037 Intermediate Similarity NPC328155
0.7037 Intermediate Similarity NPC229373
0.7037 Intermediate Similarity NPC311973
0.7037 Intermediate Similarity NPC42663
0.7037 Intermediate Similarity NPC185639
0.7037 Intermediate Similarity NPC290582
0.7037 Intermediate Similarity NPC49075
0.7037 Intermediate Similarity NPC279228
0.7037 Intermediate Similarity NPC181796
0.7037 Intermediate Similarity NPC223690
0.7037 Intermediate Similarity NPC239824
0.7037 Intermediate Similarity NPC258657
0.7037 Intermediate Similarity NPC271013
0.7037 Intermediate Similarity NPC251735
0.7037 Intermediate Similarity NPC104196
0.7035 Intermediate Similarity NPC470930
0.7029 Intermediate Similarity NPC278525
0.7028 Intermediate Similarity NPC67401

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC476999 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
0.7917 Intermediate Similarity NPD7222 Phase 2
0.7917 Intermediate Similarity NPD7956 Approved
0.7917 Intermediate Similarity NPD7955 Approved
0.7905 Intermediate Similarity NPD4418 Discontinued
0.79 Intermediate Similarity NPD3816 Phase 1
0.79 Intermediate Similarity NPD3815 Phase 1
0.7884 Intermediate Similarity NPD7708 Approved
0.7755 Intermediate Similarity NPD7803 Approved
0.7702 Intermediate Similarity NPD7417 Discontinued
0.7671 Intermediate Similarity NPD7452 Approved
0.7671 Intermediate Similarity NPD7453 Approved
0.7667 Intermediate Similarity NPD6503 Clinical (unspecified phase)
0.7642 Intermediate Similarity NPD3924 Approved
0.7642 Intermediate Similarity NPD3921 Approved
0.7642 Intermediate Similarity NPD3923 Approved
0.7642 Intermediate Similarity NPD3922 Approved
0.7621 Intermediate Similarity NPD3920 Phase 2
0.7617 Intermediate Similarity NPD6550 Discontinued
0.7611 Intermediate Similarity NPD3763 Approved
0.7597 Intermediate Similarity NPD6494 Phase 2
0.749 Intermediate Similarity NPD7862 Clinical (unspecified phase)
0.7439 Intermediate Similarity NPD7169 Suspended
0.7434 Intermediate Similarity NPD5902 Approved
0.7434 Intermediate Similarity NPD5903 Approved
0.7432 Intermediate Similarity NPD5429 Discontinued
0.7422 Intermediate Similarity NPD7069 Discontinued
0.7419 Intermediate Similarity NPD6621 Clinical (unspecified phase)
0.7418 Intermediate Similarity NPD7859 Phase 2
0.7407 Intermediate Similarity NPD6861 Clinical (unspecified phase)
0.7373 Intermediate Similarity NPD6741 Clinical (unspecified phase)
0.7371 Intermediate Similarity NPD7719 Discontinued
0.7336 Intermediate Similarity NPD6525 Clinical (unspecified phase)
0.7336 Intermediate Similarity NPD7395 Discontinued
0.7321 Intermediate Similarity NPD5658 Approved
0.7321 Intermediate Similarity NPD8156 Discontinued
0.7319 Intermediate Similarity NPD8052 Clinical (unspecified phase)
0.7302 Intermediate Similarity NPD6773 Clinical (unspecified phase)
0.7292 Intermediate Similarity NPD7886 Phase 2
0.7292 Intermediate Similarity NPD7885 Phase 2
0.7284 Intermediate Similarity NPD8100 Phase 3
0.7277 Intermediate Similarity NPD4889 Approved
0.7277 Intermediate Similarity NPD7710 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD8251 Approved
0.7273 Intermediate Similarity NPD8252 Approved
0.7273 Intermediate Similarity NPD8099 Discontinued
0.7265 Intermediate Similarity NPD3946 Clinical (unspecified phase)
0.726 Intermediate Similarity NPD6988 Phase 1
0.7243 Intermediate Similarity NPD5256 Discontinued
0.7237 Intermediate Similarity NPD7571 Clinical (unspecified phase)
0.7234 Intermediate Similarity NPD6553 Clinical (unspecified phase)
0.7231 Intermediate Similarity NPD6716 Phase 1
0.7227 Intermediate Similarity NPD7558 Phase 2
0.7215 Intermediate Similarity NPD5512 Phase 3
0.7209 Intermediate Similarity NPD6257 Clinical (unspecified phase)
0.7197 Intermediate Similarity NPD6964 Approved
0.7197 Intermediate Similarity NPD6963 Approved
0.7195 Intermediate Similarity NPD8101 Phase 3
0.7175 Intermediate Similarity NPD6477 Clinical (unspecified phase)
0.7156 Intermediate Similarity NPD3842 Clinical (unspecified phase)
0.7156 Intermediate Similarity NPD6569 Phase 2
0.715 Intermediate Similarity NPD5083 Clinical (unspecified phase)
0.7149 Intermediate Similarity NPD7025 Clinical (unspecified phase)
0.713 Intermediate Similarity NPD6140 Clinical (unspecified phase)
0.7124 Intermediate Similarity NPD7678 Clinical (unspecified phase)
0.7124 Intermediate Similarity NPD7180 Phase 3
0.7124 Intermediate Similarity NPD5930 Phase 3
0.7114 Intermediate Similarity NPD7868 Clinical (unspecified phase)
0.7113 Intermediate Similarity NPD4885 Approved
0.7089 Intermediate Similarity NPD7994 Phase 2
0.7056 Intermediate Similarity NPD5482 Discontinued
0.7046 Intermediate Similarity NPD7676 Clinical (unspecified phase)
0.7046 Intermediate Similarity NPD7675 Phase 3
0.7046 Intermediate Similarity NPD7674 Phase 3
0.7043 Intermediate Similarity NPD5866 Approved
0.7039 Intermediate Similarity NPD6568 Discontinued
0.7037 Intermediate Similarity NPD8054 Approved
0.7037 Intermediate Similarity NPD8053 Approved
0.7037 Intermediate Similarity NPD7729 Clinical (unspecified phase)
0.702 Intermediate Similarity NPD1483 Discontinued
0.7018 Intermediate Similarity NPD5863 Clinical (unspecified phase)
0.7017 Intermediate Similarity NPD7268 Clinical (unspecified phase)
0.7009 Intermediate Similarity NPD7194 Discontinued
0.7004 Intermediate Similarity NPD3003 Approved
0.7004 Intermediate Similarity NPD5530 Phase 1
0.7004 Intermediate Similarity NPD8359 Phase 2
0.7 Intermediate Similarity NPD4502 Phase 2
0.6992 Remote Similarity NPD6824 Clinical (unspecified phase)
0.6986 Remote Similarity NPD5677 Discontinued
0.6983 Remote Similarity NPD7538 Clinical (unspecified phase)
0.6982 Remote Similarity NPD3477 Phase 2
0.6982 Remote Similarity NPD3478 Clinical (unspecified phase)
0.6979 Remote Similarity NPD5070 Clinical (unspecified phase)
0.6977 Remote Similarity NPD3386 Phase 2
0.6975 Remote Similarity NPD7426 Phase 1
0.6966 Remote Similarity NPD8109 Clinical (unspecified phase)
0.6966 Remote Similarity NPD6985 Discontinued
0.6966 Remote Similarity NPD5632 Approved
0.6964 Remote Similarity NPD5483 Clinical (unspecified phase)
0.6958 Remote Similarity NPD7589 Clinical (unspecified phase)
0.6953 Remote Similarity NPD5612 Discontinued
0.6937 Remote Similarity NPD6590 Discontinued
0.6936 Remote Similarity NPD6974 Phase 3
0.6933 Remote Similarity NPD4396 Clinical (unspecified phase)
0.6917 Remote Similarity NPD8049 Phase 2
0.6905 Remote Similarity NPD8463 Approved
0.6901 Remote Similarity NPD7796 Approved
0.6901 Remote Similarity NPD7797 Approved
0.6898 Remote Similarity NPD4204 Approved
0.6898 Remote Similarity NPD4203 Approved
0.6897 Remote Similarity NPD4927 Discontinued
0.6897 Remote Similarity NPD7684 Approved
0.6897 Remote Similarity NPD7682 Approved
0.6892 Remote Similarity NPD6361 Phase 2
0.6888 Remote Similarity NPD4952 Phase 3
0.6886 Remote Similarity NPD4033 Approved
0.6886 Remote Similarity NPD4036 Approved
0.6886 Remote Similarity NPD4037 Approved
0.6886 Remote Similarity NPD4038 Approved
0.6886 Remote Similarity NPD4035 Approved
0.6886 Remote Similarity NPD31 Approved
0.6886 Remote Similarity NPD4122 Approved
0.6886 Remote Similarity NPD32 Approved
0.6886 Remote Similarity NPD4039 Approved
0.6886 Remote Similarity NPD4034 Approved
0.688 Remote Similarity NPD8102 Discontinued
0.6877 Remote Similarity NPD8442 Discontinued
0.687 Remote Similarity NPD8016 Phase 3
0.687 Remote Similarity NPD8017 Clinical (unspecified phase)
0.6864 Remote Similarity NPD3514 Clinical (unspecified phase)
0.6861 Remote Similarity NPD7690 Clinical (unspecified phase)
0.6861 Remote Similarity NPD6491 Clinical (unspecified phase)
0.6858 Remote Similarity NPD6219 Discontinued
0.6856 Remote Similarity NPD4305 Clinical (unspecified phase)
0.6853 Remote Similarity NPD6243 Phase 3
0.6853 Remote Similarity NPD6244 Phase 3
0.6846 Remote Similarity NPD8364 Approved
0.6846 Remote Similarity NPD8363 Approved
0.684 Remote Similarity NPD4724 Clinical (unspecified phase)
0.6834 Remote Similarity NPD7673 Phase 3
0.6833 Remote Similarity NPD3263 Phase 3
0.683 Remote Similarity NPD7667 Clinical (unspecified phase)
0.6827 Remote Similarity NPD6230 Discontinued
0.6824 Remote Similarity NPD8091 Phase 3
0.682 Remote Similarity NPD7414 Clinical (unspecified phase)
0.6818 Remote Similarity NPD8467 Approved
0.6818 Remote Similarity NPD8465 Approved
0.6818 Remote Similarity NPD8466 Approved
0.6814 Remote Similarity NPD3837 Clinical (unspecified phase)
0.6814 Remote Similarity NPD4118 Clinical (unspecified phase)
0.6813 Remote Similarity NPD8350 Clinical (unspecified phase)
0.6812 Remote Similarity NPD3397 Phase 2
0.6804 Remote Similarity NPD6344 Clinical (unspecified phase)
0.6803 Remote Similarity NPD4373 Phase 2
0.68 Remote Similarity NPD6769 Clinical (unspecified phase)
0.6795 Remote Similarity NPD5944 Phase 1
0.6795 Remote Similarity NPD5945 Phase 1
0.6794 Remote Similarity NPD8365 Clinical (unspecified phase)
0.6793 Remote Similarity NPD3875 Discontinued
0.679 Remote Similarity NPD6962 Phase 2
0.6786 Remote Similarity NPD3324 Clinical (unspecified phase)
0.6784 Remote Similarity NPD8244 Phase 2
0.6783 Remote Similarity NPD8403 Phase 1
0.6781 Remote Similarity NPD6220 Phase 3
0.6781 Remote Similarity NPD4131 Phase 3
0.678 Remote Similarity NPD7823 Clinical (unspecified phase)
0.6777 Remote Similarity NPD5559 Phase 2
0.6776 Remote Similarity NPD7807 Clinical (unspecified phase)
0.6773 Remote Similarity NPD8358 Approved
0.6766 Remote Similarity NPD5417 Clinical (unspecified phase)
0.6765 Remote Similarity NPD3590 Clinical (unspecified phase)
0.6763 Remote Similarity NPD7224 Discontinued
0.6763 Remote Similarity NPD7223 Discontinued
0.6763 Remote Similarity NPD7051 Phase 3
0.6763 Remote Similarity NPD7050 Clinical (unspecified phase)
0.6747 Remote Similarity NPD4876 Phase 3
0.6747 Remote Similarity NPD4875 Phase 3
0.6747 Remote Similarity NPD6517 Phase 3
0.6742 Remote Similarity NPD1034 Phase 3
0.6742 Remote Similarity NPD1033 Clinical (unspecified phase)
0.674 Remote Similarity NPD1768 Approved
0.6736 Remote Similarity NPD5507 Approved
0.6736 Remote Similarity NPD5506 Approved
0.6736 Remote Similarity NPD5147 Discontinued
0.6734 Remote Similarity NPD2921 Clinical (unspecified phase)
0.6731 Remote Similarity NPD5450 Discontinued
0.6725 Remote Similarity NPD5005 Approved
0.6725 Remote Similarity NPD5006 Approved
0.6724 Remote Similarity NPD7671 Approved
0.6724 Remote Similarity NPD7672 Approved
0.6721 Remote Similarity NPD5805 Approved
0.672 Remote Similarity NPD7592 Phase 2
0.6716 Remote Similarity NPD8459 Approved
0.6716 Remote Similarity NPD8426 Approved
0.6716 Remote Similarity NPD8425 Approved
0.6716 Remote Similarity NPD8460 Approved
0.6712 Remote Similarity NPD7549 Discontinued
0.6712 Remote Similarity NPD7906 Approved
0.671 Remote Similarity NPD5601 Phase 2
0.6709 Remote Similarity NPD5416 Discontinued
0.6709 Remote Similarity NPD7468 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   44559517
ChEMBL   CHEMBL510521
ZINC  

Physicochemical Properties

Molecular Weight:  615.21
ALogP:  -0.2835
MLogP:  3.99
XLogP:  3.929
# Rotatable Bonds:  17
Polar Surface Area:  112.91
# H-Bond Aceptor:  3
# H-Bond Donor:  0
# Rings:  6
# Heavy Atoms:  45

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Biological Activities  
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