Natural Product: NPC258674

Natural Product ID:  NPC258674
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C20H34O4
Standard InCHIKey:  TYUIIMQERZUJOC-ZOPCPIMVSA-N
Standard InCHI:  InChI=1S/C20H34O4/c1-7-14(2)15(21)13-20(24)17(5)10-8-9-16(3,4)19(17,23)12-11-18(20,6)22/h7,22-24H,8-13H2,1-6H3/b14-7+/t17-,18+,19+,20-/m0/s1
Canonical SMILES:  C/C=C(/C(=O)C[C@@]1(O)[C@](C)(O)CC[C@@]2([C@]1(C)CCCC2(C)C)O)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
NPO26575 Scapania undulata Species Scapaniaceae Eukaryota UNPD*
NPO26390 Triphasia trifolia Species Rutaceae Eukaryota UNPD*
NPO25961 Liatris graminifolia Species Asteraceae Eukaryota UNPD*
NPO10837 Matthiola incana Species Brassicaceae Eukaryota UNPD*
NPO6609 Trigonostemon heterophyllus Species Euphorbiaceae Eukaryota UNPD*
NPO26519 Acanthodoris nanaimoensis Species Onchidorididae Eukaryota UNPD*
NPO26818 Euphorbia kaleniczenkii Species Euphorbiaceae Eukaryota UNPD*
NPO26360 Methysticodendron amesianum NA NA NA UNPD*
NPO26872 Piper betle Species Piperaceae Eukaryota UNPD*
NPO26178 Guarea glabra Species Meliaceae Eukaryota UNPD*
NPO4408 Alstonia rostrata Species Apocynaceae Eukaryota UNPD*
NPO25939 Lupinus macounii Species Fabaceae Eukaryota UNPD*
NPO7055 Lychnophora hakeaefolia Species Asteraceae Eukaryota UNPD*
NPO26275 Dactynotus rudbeckiae NA NA NA UNPD*
NPO937 Limnodynastes terraereginae Species Myobatrachidae 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 26252628
NPT82 Cell Line MDA-MB-231 Homo sapiens IC50 > 10000 nM 26252628
NPT179 Cell Line A2780 Homo sapiens IC50 > 10000 nM 26252628
NPT165 Cell Line HeLa Homo sapiens IC50 > 10000 nM 26252628
NPT139 Cell Line HT-29 Homo sapiens IC50 > 10000 nM 26252628
NPT737 Cell Line HUVEC Homo sapiens IC50 > 10000 nM 26252628

  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 NPC258674 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
0.8913 High Similarity NPC103527
0.875 High Similarity NPC251170
0.8081 Intermediate Similarity NPC127408
0.8081 Intermediate Similarity NPC291785
0.8041 Intermediate Similarity NPC41070
0.8 Intermediate Similarity NPC474229
0.8 Intermediate Similarity NPC146945
0.8 Intermediate Similarity NPC171888
0.8 Intermediate Similarity NPC473217
0.7961 Intermediate Similarity NPC83744
0.7961 Intermediate Similarity NPC477916
0.7938 Intermediate Similarity NPC196227
0.7905 Intermediate Similarity NPC474567
0.7885 Intermediate Similarity NPC217201
0.7885 Intermediate Similarity NPC329417
0.7879 Intermediate Similarity NPC472689
0.7879 Intermediate Similarity NPC273269
0.7879 Intermediate Similarity NPC477268
0.7879 Intermediate Similarity NPC477267
0.7879 Intermediate Similarity NPC170978
0.7879 Intermediate Similarity NPC472690
0.7864 Intermediate Similarity NPC150531
0.7864 Intermediate Similarity NPC296945
0.7864 Intermediate Similarity NPC50692
0.7864 Intermediate Similarity NPC49958
0.7864 Intermediate Similarity NPC302607
0.7864 Intermediate Similarity NPC48733
0.7864 Intermediate Similarity NPC260268
0.7864 Intermediate Similarity NPC214264
0.7864 Intermediate Similarity NPC476027
0.7864 Intermediate Similarity NPC171137
0.7864 Intermediate Similarity NPC152695
0.7864 Intermediate Similarity NPC319077
0.7864 Intermediate Similarity NPC202167
0.7864 Intermediate Similarity NPC85829
0.7864 Intermediate Similarity NPC97202
0.7857 Intermediate Similarity NPC473170
0.785 Intermediate Similarity NPC208998
0.785 Intermediate Similarity NPC73300
0.785 Intermediate Similarity NPC7921
0.785 Intermediate Similarity NPC108721
0.785 Intermediate Similarity NPC198539
0.7812 Intermediate Similarity NPC134321
0.7812 Intermediate Similarity NPC128672
0.781 Intermediate Similarity NPC300026
0.781 Intermediate Similarity NPC11710
0.7798 Intermediate Similarity NPC97908
0.7798 Intermediate Similarity NPC474654
0.7798 Intermediate Similarity NPC122033
0.7798 Intermediate Similarity NPC470854
0.7798 Intermediate Similarity NPC287343
0.7789 Intermediate Similarity NPC158778
0.7788 Intermediate Similarity NPC475060
0.7788 Intermediate Similarity NPC220229
0.7778 Intermediate Similarity NPC473158
0.7778 Intermediate Similarity NPC61369
0.7778 Intermediate Similarity NPC469545
0.7778 Intermediate Similarity NPC5532
0.7767 Intermediate Similarity NPC475036
0.7767 Intermediate Similarity NPC65523
0.7767 Intermediate Similarity NPC209502
0.7767 Intermediate Similarity NPC204833
0.7766 Intermediate Similarity NPC262026
0.7766 Intermediate Similarity NPC179591
0.7755 Intermediate Similarity NPC472976
0.7755 Intermediate Similarity NPC472977
0.7736 Intermediate Similarity NPC235077
0.7732 Intermediate Similarity NPC116726
0.7732 Intermediate Similarity NPC472978
0.7727 Intermediate Similarity NPC251310
0.7723 Intermediate Similarity NPC46761
0.7714 Intermediate Similarity NPC65941
0.7714 Intermediate Similarity NPC231278
0.7714 Intermediate Similarity NPC112895
0.7714 Intermediate Similarity NPC168883
0.7714 Intermediate Similarity NPC102843
0.7714 Intermediate Similarity NPC218123
0.7714 Intermediate Similarity NPC29827
0.7706 Intermediate Similarity NPC207217
0.77 Intermediate Similarity NPC272451
0.77 Intermediate Similarity NPC27105
0.7692 Intermediate Similarity NPC469637
0.7692 Intermediate Similarity NPC149047
0.7692 Intermediate Similarity NPC476809
0.7692 Intermediate Similarity NPC128828
0.7685 Intermediate Similarity NPC477266
0.7677 Intermediate Similarity NPC138245
0.7677 Intermediate Similarity NPC84018
0.7677 Intermediate Similarity NPC142352
0.7677 Intermediate Similarity NPC231060
0.767 Intermediate Similarity NPC117185
0.767 Intermediate Similarity NPC191892
0.767 Intermediate Similarity NPC312900
0.7667 Intermediate Similarity NPC207772
0.7664 Intermediate Similarity NPC471243
0.7653 Intermediate Similarity NPC474807
0.7647 Intermediate Similarity NPC470184
0.7647 Intermediate Similarity NPC256247
0.7642 Intermediate Similarity NPC310546
0.7642 Intermediate Similarity NPC163004
0.7642 Intermediate Similarity NPC87335
0.764 Intermediate Similarity NPC186554
0.764 Intermediate Similarity NPC76966
0.7636 Intermediate Similarity NPC27999
0.7636 Intermediate Similarity NPC477116
0.7634 Intermediate Similarity NPC107253
0.7634 Intermediate Similarity NPC64600
0.7629 Intermediate Similarity NPC473099
0.7624 Intermediate Similarity NPC99657
0.7624 Intermediate Similarity NPC203388
0.7624 Intermediate Similarity NPC471331
0.7624 Intermediate Similarity NPC471330
0.7624 Intermediate Similarity NPC472687
0.7619 Intermediate Similarity NPC166993
0.7619 Intermediate Similarity NPC43285
0.7619 Intermediate Similarity NPC58370
0.7609 Intermediate Similarity NPC44963
0.7609 Intermediate Similarity NPC472684
0.7609 Intermediate Similarity NPC226068
0.7604 Intermediate Similarity NPC48107
0.76 Intermediate Similarity NPC91439
0.7596 Intermediate Similarity NPC284865
0.7596 Intermediate Similarity NPC474281
0.7593 Intermediate Similarity NPC472002
0.7593 Intermediate Similarity NPC90769
0.7593 Intermediate Similarity NPC205534
0.7593 Intermediate Similarity NPC207251
0.7593 Intermediate Similarity NPC269530
0.7576 Intermediate Similarity NPC29247
0.7576 Intermediate Similarity NPC111524
0.7576 Intermediate Similarity NPC471207
0.7576 Intermediate Similarity NPC289539
0.7576 Intermediate Similarity NPC478089
0.7576 Intermediate Similarity NPC261333
0.7576 Intermediate Similarity NPC91772
0.7576 Intermediate Similarity NPC104371
0.7576 Intermediate Similarity NPC215271
0.7576 Intermediate Similarity NPC302008
0.7576 Intermediate Similarity NPC191094
0.7576 Intermediate Similarity NPC101233
0.7576 Intermediate Similarity NPC153775
0.7576 Intermediate Similarity NPC129004
0.7576 Intermediate Similarity NPC292374
0.7573 Intermediate Similarity NPC162973
0.7573 Intermediate Similarity NPC477915
0.757 Intermediate Similarity NPC100908
0.7568 Intermediate Similarity NPC17772
0.7568 Intermediate Similarity NPC204552
0.7568 Intermediate Similarity NPC188667
0.7551 Intermediate Similarity NPC155304
0.7549 Intermediate Similarity NPC470388
0.7549 Intermediate Similarity NPC35239
0.7547 Intermediate Similarity NPC273155
0.7547 Intermediate Similarity NPC94942
0.7545 Intermediate Similarity NPC471816
0.7545 Intermediate Similarity NPC96312
0.7545 Intermediate Similarity NPC328374
0.7545 Intermediate Similarity NPC251236
0.7545 Intermediate Similarity NPC40632
0.7526 Intermediate Similarity NPC472676
0.7526 Intermediate Similarity NPC472688
0.7526 Intermediate Similarity NPC472973
0.7526 Intermediate Similarity NPC473100
0.7525 Intermediate Similarity NPC111187
0.7525 Intermediate Similarity NPC190080
0.7525 Intermediate Similarity NPC106112
0.7525 Intermediate Similarity NPC261935
0.7524 Intermediate Similarity NPC471332
0.7524 Intermediate Similarity NPC166607
0.7524 Intermediate Similarity NPC471333
0.7524 Intermediate Similarity NPC102352
0.7524 Intermediate Similarity NPC138908
0.7524 Intermediate Similarity NPC200957
0.7523 Intermediate Similarity NPC49451
0.7523 Intermediate Similarity NPC317210
0.7522 Intermediate Similarity NPC477046
0.7522 Intermediate Similarity NPC102822
0.75 Intermediate Similarity NPC469488
0.75 Intermediate Similarity NPC209298
0.75 Intermediate Similarity NPC476023
0.75 Intermediate Similarity NPC471792
0.75 Intermediate Similarity NPC272617
0.75 Intermediate Similarity NPC470777
0.75 Intermediate Similarity NPC472324
0.75 Intermediate Similarity NPC266899
0.75 Intermediate Similarity NPC476245
0.75 Intermediate Similarity NPC298904
0.75 Intermediate Similarity NPC277074
0.75 Intermediate Similarity NPC200702
0.7477 Intermediate Similarity NPC475809
0.7477 Intermediate Similarity NPC470257
0.7477 Intermediate Similarity NPC214644
0.7477 Intermediate Similarity NPC134430
0.7476 Intermediate Similarity NPC46848
0.7475 Intermediate Similarity NPC131840
0.7475 Intermediate Similarity NPC59170
0.7475 Intermediate Similarity NPC181594
0.7475 Intermediate Similarity NPC144739
0.7474 Intermediate Similarity NPC79573
0.7456 Intermediate Similarity NPC170538

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC258674 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
0.7766 Intermediate Similarity NPD3574 Clinical (unspecified phase)
0.7736 Intermediate Similarity NPD4634 Approved
0.7383 Intermediate Similarity NPD5345 Clinical (unspecified phase)
0.7379 Intermediate Similarity NPD5286 Approved
0.7379 Intermediate Similarity NPD4696 Approved
0.7379 Intermediate Similarity NPD5285 Approved
0.7374 Intermediate Similarity NPD6079 Approved
0.7353 Intermediate Similarity NPD4755 Approved
0.7347 Intermediate Similarity NPD5328 Approved
0.7238 Intermediate Similarity NPD5224 Approved
0.7238 Intermediate Similarity NPD4633 Approved
0.7238 Intermediate Similarity NPD5226 Approved
0.7238 Intermediate Similarity NPD5211 Phase 2
0.7238 Intermediate Similarity NPD5225 Approved
0.7216 Intermediate Similarity NPD3618 Phase 1
0.7212 Intermediate Similarity NPD4700 Approved
0.717 Intermediate Similarity NPD5174 Approved
0.717 Intermediate Similarity NPD5175 Approved
0.7143 Intermediate Similarity NPD5223 Approved
0.7143 Intermediate Similarity NPD3573 Approved
0.713 Intermediate Similarity NPD6054 Approved
0.713 Intermediate Similarity NPD6319 Approved
0.7128 Intermediate Similarity NPD4695 Discontinued
0.7103 Intermediate Similarity NPD5141 Approved
0.7087 Intermediate Similarity NPD5221 Approved
0.7087 Intermediate Similarity NPD5222 Approved
0.7087 Intermediate Similarity NPD4697 Phase 3
0.7087 Intermediate Similarity NPD5220 Clinical (unspecified phase)
0.7064 Intermediate Similarity NPD6881 Approved
0.7064 Intermediate Similarity NPD6899 Approved
0.7054 Intermediate Similarity NPD4632 Approved
0.7037 Intermediate Similarity NPD5739 Approved
0.7037 Intermediate Similarity NPD6402 Approved
0.7037 Intermediate Similarity NPD7128 Approved
0.7037 Intermediate Similarity NPD6675 Approved
0.703 Intermediate Similarity NPD7515 Phase 2
0.7027 Intermediate Similarity NPD6650 Approved
0.7027 Intermediate Similarity NPD6649 Approved
0.7019 Intermediate Similarity NPD7902 Approved
0.7019 Intermediate Similarity NPD5173 Approved
0.7009 Intermediate Similarity NPD6370 Approved
0.7 Intermediate Similarity NPD6372 Approved
0.7 Intermediate Similarity NPD6373 Approved
0.6983 Remote Similarity NPD6059 Approved
0.6979 Remote Similarity NPD4223 Phase 3
0.6979 Remote Similarity NPD4221 Approved
0.6972 Remote Similarity NPD5697 Approved
0.6964 Remote Similarity NPD8297 Approved
0.6961 Remote Similarity NPD4202 Approved
0.6949 Remote Similarity NPD8328 Phase 3
0.6939 Remote Similarity NPD5329 Approved
0.6937 Remote Similarity NPD7290 Approved
0.6937 Remote Similarity NPD6883 Approved
0.6937 Remote Similarity NPD7102 Approved
0.6923 Remote Similarity NPD6015 Approved
0.6923 Remote Similarity NPD6016 Approved
0.6909 Remote Similarity NPD4730 Approved
0.6909 Remote Similarity NPD4729 Approved
0.6909 Remote Similarity NPD5128 Approved
0.6909 Remote Similarity NPD7320 Approved
0.6893 Remote Similarity NPD7748 Approved
0.6891 Remote Similarity NPD7492 Approved
0.6881 Remote Similarity NPD4768 Approved
0.6881 Remote Similarity NPD4767 Approved
0.6875 Remote Similarity NPD6869 Approved
0.6875 Remote Similarity NPD8130 Phase 1
0.6875 Remote Similarity NPD6847 Approved
0.6875 Remote Similarity NPD6617 Approved
0.687 Remote Similarity NPD7115 Discovery
0.6864 Remote Similarity NPD5988 Approved
0.6852 Remote Similarity NPD4754 Approved
0.6847 Remote Similarity NPD4061 Clinical (unspecified phase)
0.6847 Remote Similarity NPD6014 Approved
0.6847 Remote Similarity NPD6013 Approved
0.6847 Remote Similarity NPD6012 Approved
0.6837 Remote Similarity NPD4197 Approved
0.6833 Remote Similarity NPD6616 Approved
0.6832 Remote Similarity NPD4753 Phase 2
0.6827 Remote Similarity NPD4629 Approved
0.6827 Remote Similarity NPD5210 Approved
0.6818 Remote Similarity NPD7331 Phase 2
0.6818 Remote Similarity NPD5701 Approved
0.6814 Remote Similarity NPD6882 Approved
0.6792 Remote Similarity NPD4225 Approved
0.6786 Remote Similarity NPD5251 Approved
0.6786 Remote Similarity NPD5955 Clinical (unspecified phase)
0.6786 Remote Similarity NPD5249 Phase 3
0.6786 Remote Similarity NPD5247 Approved
0.6786 Remote Similarity NPD5248 Approved
0.6786 Remote Similarity NPD5250 Approved
0.6777 Remote Similarity NPD7078 Approved
0.6757 Remote Similarity NPD6011 Approved
0.6731 Remote Similarity NPD7900 Approved
0.6731 Remote Similarity NPD7901 Clinical (unspecified phase)
0.6727 Remote Similarity NPD6008 Approved
0.6726 Remote Similarity NPD5217 Approved
0.6726 Remote Similarity NPD5215 Approved
0.6726 Remote Similarity NPD5216 Approved
0.6724 Remote Similarity NPD6009 Approved
0.6721 Remote Similarity NPD7736 Approved
0.67 Remote Similarity NPD4138 Approved
0.67 Remote Similarity NPD4688 Approved
0.67 Remote Similarity NPD4689 Approved
0.67 Remote Similarity NPD4519 Discontinued
0.67 Remote Similarity NPD5690 Phase 2
0.67 Remote Similarity NPD5205 Approved
0.67 Remote Similarity NPD4623 Approved
0.67 Remote Similarity NPD4690 Approved
0.67 Remote Similarity NPD4693 Phase 3
0.6699 Remote Similarity NPD5281 Approved
0.6699 Remote Similarity NPD5284 Approved
0.6667 Remote Similarity NPD4786 Approved
0.6667 Remote Similarity NPD3665 Phase 1
0.6667 Remote Similarity NPD3133 Approved
0.6667 Remote Similarity NPD7319 Approved
0.6667 Remote Similarity NPD3666 Approved
0.6667 Remote Similarity NPD6412 Phase 2
0.6639 Remote Similarity NPD6921 Approved
0.6639 Remote Similarity NPD8293 Discontinued
0.6637 Remote Similarity NPD5135 Approved
0.6637 Remote Similarity NPD5169 Approved
0.6637 Remote Similarity NPD5134 Clinical (unspecified phase)
0.6635 Remote Similarity NPD6399 Phase 3
0.6633 Remote Similarity NPD3667 Approved
0.6579 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6579 Remote Similarity NPD5127 Approved
0.6571 Remote Similarity NPD5282 Discontinued
0.6562 Remote Similarity NPD3617 Approved
0.6549 Remote Similarity NPD8132 Clinical (unspecified phase)
0.6542 Remote Similarity NPD6084 Phase 2
0.6542 Remote Similarity NPD6083 Phase 2
0.6535 Remote Similarity NPD4694 Approved
0.6535 Remote Similarity NPD5280 Approved
0.6529 Remote Similarity NPD7604 Phase 2
0.6518 Remote Similarity NPD5954 Clinical (unspecified phase)
0.6517 Remote Similarity NPD7341 Phase 2
0.6509 Remote Similarity NPD6356 Clinical (unspecified phase)
0.6505 Remote Similarity NPD7285 Clinical (unspecified phase)
0.65 Remote Similarity NPD5983 Phase 2
0.6496 Remote Similarity NPD6274 Approved
0.6495 Remote Similarity NPD4195 Approved
0.6481 Remote Similarity NPD5696 Approved
0.6481 Remote Similarity NPD7638 Approved
0.6471 Remote Similarity NPD4522 Approved
0.6471 Remote Similarity NPD7101 Approved
0.6471 Remote Similarity NPD7100 Approved
0.6465 Remote Similarity NPD4800 Clinical (unspecified phase)
0.646 Remote Similarity NPD5168 Approved
0.646 Remote Similarity NPD6686 Approved
0.6452 Remote Similarity NPD6033 Approved
0.6449 Remote Similarity NPD7614 Phase 1
0.6441 Remote Similarity NPD8295 Clinical (unspecified phase)
0.6429 Remote Similarity NPD7525 Registered
0.6423 Remote Similarity NPD6336 Discontinued
0.6423 Remote Similarity NPD7507 Approved
0.6422 Remote Similarity NPD7639 Approved
0.6422 Remote Similarity NPD7640 Approved
0.641 Remote Similarity NPD5167 Approved
0.64 Remote Similarity NPD4788 Approved
0.6387 Remote Similarity NPD6335 Approved
0.6381 Remote Similarity NPD6411 Approved
0.6364 Remote Similarity NPD5344 Discontinued
0.6355 Remote Similarity NPD5695 Phase 3
0.6346 Remote Similarity NPD6904 Approved
0.6346 Remote Similarity NPD6080 Approved
0.6346 Remote Similarity NPD6673 Approved
0.6344 Remote Similarity NPD4691 Approved
0.6337 Remote Similarity NPD3668 Phase 3
0.6321 Remote Similarity NPD5778 Approved
0.6321 Remote Similarity NPD5779 Approved
0.6306 Remote Similarity NPD5091 Approved
0.6303 Remote Similarity NPD6317 Approved
0.6262 Remote Similarity NPD6001 Approved
0.625 Remote Similarity NPD6672 Approved
0.625 Remote Similarity NPD6313 Approved
0.625 Remote Similarity NPD5737 Approved
0.625 Remote Similarity NPD6314 Approved
0.6237 Remote Similarity NPD4137 Phase 3
0.623 Remote Similarity NPD6909 Approved
0.623 Remote Similarity NPD6908 Approved
0.623 Remote Similarity NPD6291 Clinical (unspecified phase)
0.6226 Remote Similarity NPD8035 Phase 2
0.6226 Remote Similarity NPD8034 Phase 2
0.6218 Remote Similarity NPD6868 Approved
0.6214 Remote Similarity NPD6684 Approved
0.6214 Remote Similarity NPD7334 Approved
0.6214 Remote Similarity NPD5279 Phase 3
0.6214 Remote Similarity NPD5330 Approved
0.6214 Remote Similarity NPD7146 Approved
0.6214 Remote Similarity NPD6409 Approved
0.6214 Remote Similarity NPD7521 Approved
0.6207 Remote Similarity NPD6371 Approved
0.6204 Remote Similarity NPD1698 Clinical (unspecified phase)
0.6198 Remote Similarity NPD7516 Approved
0.619 Remote Similarity NPD5764 Clinical (unspecified phase)
0.619 Remote Similarity NPD6101 Approved
0.617 Remote Similarity NPD4747 Approved
0.6162 Remote Similarity NPD7645 Phase 2
0.6154 Remote Similarity NPD7524 Approved
0.6146 Remote Similarity NPD4058 Approved

Structure

External Identifiers

PubChem CID  
ChEMBL   CHEMBL3600944
ZINC  

Physicochemical Properties

Molecular Weight:  338.25
ALogP:  0.863
MLogP:  3.22
XLogP:  3.514
# Rotatable Bonds:  12
Polar Surface Area:  77.76
# H-Bond Aceptor:  4
# H-Bond Donor:  3
# Rings:  2
# Heavy Atoms:  24

Download Data

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