Natural Product: NPC233256

Natural Product ID:  NPC233256
Common Name:   Paravallarine
IUPAC Name:  
Synonyms:   Paravallarine
Molecular Formula:   C22H33NO2
Standard InCHIKey:  RSFPISDAJMWREU-CDFICMNGSA-N
Standard InCHI:  InChI=1S/C22H33NO2/c1-13-17-6-7-19-16-5-4-14-12-15(23-3)8-10-21(14,2)18(16)9-11-22(17,19)20(24)25-13/h4,13,15-19,23H,5-12H2,1-3H3/t13-,15-,16+,17+,18-,19-,21-,22-/m0/s1
Canonical SMILES:  CN[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]24[C@H]3CC[C@@H]4[C@@H](OC2=O)C)C1)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
NPO11073 Alpinia formosana Species Zingiberaceae Eukaryota UNPD*
NPO14583 Elsholtzia stauntonii Species Lamiaceae Eukaryota UNPD*
NPO30860 Kibatalia laurifolia Species Apocynaceae Eukaryota leaves PMID[21443172]
NPO10834 Protea compacta Species Proteaceae Eukaryota UNPD*
NPO1421 Papaver hybrid Species Papaveraceae Eukaryota UNPD*
NPO805 Myrmicaria opaciventris Species Formicidae Eukaryota UNPD*
NPO13993 Dimelaena thysanota Species Caliciaceae Eukaryota UNPD*
NPO11334 Rubus moluccanus Species Rosaceae Eukaryota UNPD*
NPO10561 Mentha suaveolens Species Lamiaceae Eukaryota UNPD*
NPO765 Holarrhena pubescens Species Apocynaceae Eukaryota UNPD*
NPO14603 Flindersia australis Species Rutaceae Eukaryota UNPD*
NPO11532 Bidens parviflora Species Asteraceae Eukaryota UNPD*
NPO4862 Westiellopsis prolifica Species Hapalosiphonaceae Bacteria UNPD*
NPO21147 Anisocycla grandidieri Species Menispermaceae Eukaryota UNPD*
NPO3577 Bambusa tulda Species Poaceae Eukaryota UNPD*
NPO9025 Croton balsamifer Species Euphorbiaceae Eukaryota UNPD*
NPO6627 Pinus bungeana Species Pinaceae Eukaryota UNPD*
NPO14386 Piper hostmannianum Species Piperaceae Eukaryota UNPD*
NPO8641 Haemanthus tigrinus Species Amaryllidaceae Eukaryota UNPD*
NPO12589 Heliotropium angiospermum Species Heliotropiaceae Eukaryota UNPD*
NPO13117 Asparagus setaceus Species Asparagaceae Eukaryota UNPD*
NPO13898 Typhonium flagelliforme Species Araceae Eukaryota UNPD*
NPO27640 Sorbus tianschanica Species Rosaceae Eukaryota TCMID*
NPO20553 Zingiber officinale Species Zingiberaceae Eukaryota TCMID*
NPO765 Holarrhena pubescens Species Apocynaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT91 Cell Line KB Homo sapiens IC50 = 12800 nM 21443172

  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 NPC233256 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 NPC195841
0.9485 High Similarity NPC239768
0.9485 High Similarity NPC128698
0.8899 High Similarity NPC35037
0.8738 High Similarity NPC119329
0.8598 High Similarity NPC79238
0.8505 High Similarity NPC472313
0.8426 Intermediate Similarity NPC474459
0.8349 Intermediate Similarity NPC474452
0.8333 Intermediate Similarity NPC63511
0.8131 Intermediate Similarity NPC86906
0.8113 Intermediate Similarity NPC98765
0.7959 Intermediate Similarity NPC470223
0.7921 Intermediate Similarity NPC84171
0.79 Intermediate Similarity NPC28227
0.7857 Intermediate Similarity NPC100391
0.7755 Intermediate Similarity NPC21667
0.7686 Intermediate Similarity NPC478136
0.7624 Intermediate Similarity NPC167877
0.76 Intermediate Similarity NPC75810
0.7596 Intermediate Similarity NPC470224
0.7568 Intermediate Similarity NPC244982
0.7568 Intermediate Similarity NPC476756
0.7525 Intermediate Similarity NPC264127
0.7477 Intermediate Similarity NPC474164
0.7459 Intermediate Similarity NPC96010
0.7459 Intermediate Similarity NPC317654
0.7434 Intermediate Similarity NPC147835
0.7434 Intermediate Similarity NPC85001
0.7434 Intermediate Similarity NPC95920
0.7434 Intermediate Similarity NPC253645
0.7383 Intermediate Similarity NPC322063
0.7379 Intermediate Similarity NPC472220
0.7379 Intermediate Similarity NPC97884
0.7364 Intermediate Similarity NPC176012
0.7358 Intermediate Similarity NPC476754
0.7353 Intermediate Similarity NPC195640
0.7353 Intermediate Similarity NPC470050
0.7353 Intermediate Similarity NPC470051
0.7315 Intermediate Similarity NPC475894
0.7273 Intermediate Similarity NPC170038
0.7264 Intermediate Similarity NPC476752
0.7264 Intermediate Similarity NPC476753
0.7264 Intermediate Similarity NPC93027
0.7255 Intermediate Similarity NPC323765
0.7248 Intermediate Similarity NPC153792
0.7248 Intermediate Similarity NPC271387
0.7241 Intermediate Similarity NPC124358
0.7238 Intermediate Similarity NPC471896
0.7232 Intermediate Similarity NPC475239
0.7217 Intermediate Similarity NPC72753
0.7212 Intermediate Similarity NPC474845
0.7207 Intermediate Similarity NPC58200
0.7196 Intermediate Similarity NPC56525
0.7184 Intermediate Similarity NPC155011
0.7182 Intermediate Similarity NPC135799
0.7172 Intermediate Similarity NPC153987
0.7172 Intermediate Similarity NPC44083
0.7172 Intermediate Similarity NPC118987
0.717 Intermediate Similarity NPC154101
0.717 Intermediate Similarity NPC218301
0.7168 Intermediate Similarity NPC230677
0.7155 Intermediate Similarity NPC66862
0.7143 Intermediate Similarity NPC474570
0.7143 Intermediate Similarity NPC478139
0.713 Intermediate Similarity NPC469599
0.7129 Intermediate Similarity NPC240302
0.7117 Intermediate Similarity NPC474348
0.7115 Intermediate Similarity NPC474684
0.7115 Intermediate Similarity NPC142361
0.7075 Intermediate Similarity NPC148414
0.7075 Intermediate Similarity NPC175628
0.7075 Intermediate Similarity NPC111585
0.7071 Intermediate Similarity NPC35574
0.7064 Intermediate Similarity NPC307164
0.7059 Intermediate Similarity NPC470047
0.7059 Intermediate Similarity NPC470538
0.7059 Intermediate Similarity NPC304646
0.7059 Intermediate Similarity NPC470046
0.7059 Intermediate Similarity NPC28280
0.7054 Intermediate Similarity NPC476755
0.7037 Intermediate Similarity NPC159410
0.7037 Intermediate Similarity NPC472223
0.7037 Intermediate Similarity NPC472224
0.703 Intermediate Similarity NPC118329
0.703 Intermediate Similarity NPC152039
0.703 Intermediate Similarity NPC474955
0.703 Intermediate Similarity NPC147066
0.703 Intermediate Similarity NPC329782
0.7009 Intermediate Similarity NPC150383
0.7009 Intermediate Similarity NPC26888
0.7 Intermediate Similarity NPC292133
0.6991 Remote Similarity NPC36688
0.6991 Remote Similarity NPC36321
0.6991 Remote Similarity NPC140723
0.699 Remote Similarity NPC109512
0.699 Remote Similarity NPC165064
0.6981 Remote Similarity NPC475921
0.6981 Remote Similarity NPC474889
0.6981 Remote Similarity NPC474704
0.6972 Remote Similarity NPC174117
0.6964 Remote Similarity NPC118275
0.6961 Remote Similarity NPC100297
0.6961 Remote Similarity NPC472312
0.696 Remote Similarity NPC237286
0.6952 Remote Similarity NPC187376
0.6952 Remote Similarity NPC233836
0.6952 Remote Similarity NPC96496
0.6952 Remote Similarity NPC159046
0.6949 Remote Similarity NPC80834
0.6949 Remote Similarity NPC469968
0.6944 Remote Similarity NPC141497
0.6944 Remote Similarity NPC170220
0.6944 Remote Similarity NPC107674
0.6944 Remote Similarity NPC470376
0.6944 Remote Similarity NPC49776
0.6944 Remote Similarity NPC474436
0.6944 Remote Similarity NPC470375
0.6944 Remote Similarity NPC63118
0.6942 Remote Similarity NPC470276
0.6937 Remote Similarity NPC252295
0.6937 Remote Similarity NPC91604
0.693 Remote Similarity NPC164835
0.693 Remote Similarity NPC255309
0.693 Remote Similarity NPC472228
0.693 Remote Similarity NPC228669
0.693 Remote Similarity NPC212874
0.693 Remote Similarity NPC472227
0.693 Remote Similarity NPC471293
0.6923 Remote Similarity NPC311769
0.6923 Remote Similarity NPC474218
0.6923 Remote Similarity NPC182106
0.6916 Remote Similarity NPC44240
0.6909 Remote Similarity NPC111684
0.6909 Remote Similarity NPC476903
0.6909 Remote Similarity NPC58052
0.69 Remote Similarity NPC4827
0.6897 Remote Similarity NPC159367
0.6887 Remote Similarity NPC294480
0.6887 Remote Similarity NPC226863
0.6881 Remote Similarity NPC471720
0.6881 Remote Similarity NPC294266
0.6875 Remote Similarity NPC476303
0.6875 Remote Similarity NPC470906
0.687 Remote Similarity NPC96377
0.6869 Remote Similarity NPC41017
0.6863 Remote Similarity NPC232625
0.6863 Remote Similarity NPC475665
0.6863 Remote Similarity NPC201912
0.6863 Remote Similarity NPC38350
0.6857 Remote Similarity NPC9892
0.6857 Remote Similarity NPC325594
0.6857 Remote Similarity NPC10005
0.6857 Remote Similarity NPC91525
0.6857 Remote Similarity NPC55309
0.6857 Remote Similarity NPC28252
0.6857 Remote Similarity NPC329943
0.6852 Remote Similarity NPC212301
0.6852 Remote Similarity NPC190442
0.6852 Remote Similarity NPC49420
0.6852 Remote Similarity NPC189520
0.6852 Remote Similarity NPC110657
0.6852 Remote Similarity NPC297265
0.6852 Remote Similarity NPC86266
0.6847 Remote Similarity NPC140300
0.6847 Remote Similarity NPC187159
0.6847 Remote Similarity NPC23680
0.6847 Remote Similarity NPC107243
0.6847 Remote Similarity NPC57416
0.6837 Remote Similarity NPC166797
0.6833 Remote Similarity NPC135431
0.6832 Remote Similarity NPC471475
0.6832 Remote Similarity NPC477371
0.6827 Remote Similarity NPC85774
0.6827 Remote Similarity NPC312660
0.6827 Remote Similarity NPC139566
0.6827 Remote Similarity NPC59453
0.6827 Remote Similarity NPC82902
0.6827 Remote Similarity NPC221758
0.6827 Remote Similarity NPC475509
0.6827 Remote Similarity NPC214043
0.6822 Remote Similarity NPC474679
0.6822 Remote Similarity NPC77168
0.6822 Remote Similarity NPC102414
0.6822 Remote Similarity NPC54689
0.6822 Remote Similarity NPC84271
0.6822 Remote Similarity NPC215029
0.6822 Remote Similarity NPC476733
0.6822 Remote Similarity NPC305039
0.6818 Remote Similarity NPC33473
0.6818 Remote Similarity NPC279974
0.6818 Remote Similarity NPC184848
0.6818 Remote Similarity NPC69548
0.6814 Remote Similarity NPC474327
0.681 Remote Similarity NPC220974
0.681 Remote Similarity NPC59530
0.68 Remote Similarity NPC472300
0.6796 Remote Similarity NPC321289
0.6796 Remote Similarity NPC133391
0.6796 Remote Similarity NPC260956

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC233256 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
0.8058 Intermediate Similarity NPD5349 Clinical (unspecified phase)
0.7379 Intermediate Similarity NPD6903 Approved
0.7353 Intermediate Similarity NPD7521 Approved
0.7353 Intermediate Similarity NPD6684 Approved
0.7353 Intermediate Similarity NPD6409 Approved
0.7353 Intermediate Similarity NPD7146 Approved
0.7353 Intermediate Similarity NPD5330 Approved
0.7353 Intermediate Similarity NPD7334 Approved
0.7264 Intermediate Similarity NPD6399 Phase 3
0.7212 Intermediate Similarity NPD7513 Clinical (unspecified phase)
0.7212 Intermediate Similarity NPD6672 Approved
0.7212 Intermediate Similarity NPD5737 Approved
0.713 Intermediate Similarity NPD6356 Clinical (unspecified phase)
0.7019 Intermediate Similarity NPD6098 Approved
0.6949 Remote Similarity NPD7335 Phase 2
0.6949 Remote Similarity NPD7336 Phase 2
0.6949 Remote Similarity NPD7337 Clinical (unspecified phase)
0.6916 Remote Similarity NPD5207 Approved
0.6881 Remote Similarity NPD6001 Approved
0.6827 Remote Similarity NPD4786 Approved
0.6822 Remote Similarity NPD6673 Approved
0.6822 Remote Similarity NPD6080 Approved
0.6822 Remote Similarity NPD6904 Approved
0.6729 Remote Similarity NPD5208 Approved
0.6724 Remote Similarity NPD6008 Approved
0.6696 Remote Similarity NPD6083 Phase 2
0.6696 Remote Similarity NPD6084 Phase 2
0.664 Remote Similarity NPD6908 Approved
0.664 Remote Similarity NPD6909 Approved
0.6637 Remote Similarity NPD5696 Approved
0.6635 Remote Similarity NPD3667 Approved
0.6613 Remote Similarity NPD7518 Approved
0.6613 Remote Similarity NPD7519 Approved
0.6613 Remote Similarity NPD7517 Approved
0.6577 Remote Similarity NPD7900 Approved
0.6577 Remote Similarity NPD7901 Clinical (unspecified phase)
0.656 Remote Similarity NPD7148 Clinical (unspecified phase)
0.656 Remote Similarity NPD7147 Phase 3
0.6552 Remote Similarity NPD6052 Approved
0.6545 Remote Similarity NPD8035 Phase 2
0.6545 Remote Similarity NPD5693 Phase 1
0.6545 Remote Similarity NPD8034 Phase 2
0.6545 Remote Similarity NPD6050 Approved
0.6542 Remote Similarity NPD3618 Phase 1
0.6535 Remote Similarity NPD7122 Discontinued
0.6518 Remote Similarity NPD5695 Phase 3
0.6514 Remote Similarity NPD5328 Approved
0.6514 Remote Similarity NPD6051 Approved
0.6509 Remote Similarity NPD3666 Approved
0.6509 Remote Similarity NPD3668 Phase 3
0.6509 Remote Similarity NPD3133 Approved
0.6509 Remote Similarity NPD3665 Phase 1
0.6471 Remote Similarity NPD7320 Approved
0.6462 Remote Similarity NPD8337 Approved
0.6462 Remote Similarity NPD8336 Approved
0.6455 Remote Similarity NPD5692 Phase 3
0.6449 Remote Similarity NPD7520 Clinical (unspecified phase)
0.6441 Remote Similarity NPD5739 Approved
0.6441 Remote Similarity NPD6402 Approved
0.6441 Remote Similarity NPD7128 Approved
0.6441 Remote Similarity NPD6675 Approved
0.6441 Remote Similarity NPD7333 Discontinued
0.6435 Remote Similarity NPD6404 Discontinued
0.6429 Remote Similarity NPD7748 Approved
0.6417 Remote Similarity NPD6373 Approved
0.6417 Remote Similarity NPD6372 Approved
0.6404 Remote Similarity NPD7902 Approved
0.6396 Remote Similarity NPD6079 Approved
0.6396 Remote Similarity NPD5694 Approved
0.6391 Remote Similarity NPD8449 Approved
0.6381 Remote Similarity NPD857 Phase 3
0.6364 Remote Similarity NPD7751 Phase 1
0.6343 Remote Similarity NPD8450 Suspended
0.6333 Remote Similarity NPD6899 Approved
0.6333 Remote Similarity NPD6881 Approved
0.6321 Remote Similarity NPD4223 Phase 3
0.6321 Remote Similarity NPD4752 Clinical (unspecified phase)
0.6321 Remote Similarity NPD4221 Approved
0.6311 Remote Similarity NPD6649 Approved
0.6311 Remote Similarity NPD6650 Approved
0.6296 Remote Similarity NPD5329 Approved
0.6296 Remote Similarity NPD1694 Approved
0.6283 Remote Similarity NPD5707 Approved
0.6283 Remote Similarity NPD5769 Clinical (unspecified phase)
0.625 Remote Similarity NPD7515 Phase 2
0.625 Remote Similarity NPD5701 Approved
0.625 Remote Similarity NPD5697 Approved
0.625 Remote Similarity NPD5281 Approved
0.625 Remote Similarity NPD5284 Approved
0.6241 Remote Similarity NPD6914 Discontinued
0.6239 Remote Similarity NPD8308 Discontinued
0.6239 Remote Similarity NPD5279 Phase 3
0.623 Remote Similarity NPD7102 Approved
0.623 Remote Similarity NPD7290 Approved
0.623 Remote Similarity NPD6883 Approved
0.623 Remote Similarity NPD6420 Discontinued
0.6216 Remote Similarity NPD4753 Phase 2
0.6207 Remote Similarity NPD7638 Approved
0.6204 Remote Similarity NPD4197 Approved
0.62 Remote Similarity NPD4747 Approved
0.6198 Remote Similarity NPD6011 Approved
0.6195 Remote Similarity NPD4202 Approved
0.6182 Remote Similarity NPD3573 Approved
0.6179 Remote Similarity NPD6401 Clinical (unspecified phase)
0.6179 Remote Similarity NPD8130 Phase 1
0.6179 Remote Similarity NPD6869 Approved
0.6179 Remote Similarity NPD6847 Approved
0.6179 Remote Similarity NPD6617 Approved
0.6174 Remote Similarity NPD7732 Phase 3
0.6174 Remote Similarity NPD4697 Phase 3
0.6154 Remote Similarity NPD8418 Phase 2
0.6154 Remote Similarity NPD7640 Approved
0.6154 Remote Similarity NPD7639 Approved
0.6148 Remote Similarity NPD6012 Approved
0.6148 Remote Similarity NPD6845 Suspended
0.6148 Remote Similarity NPD6013 Approved
0.6148 Remote Similarity NPD6014 Approved
0.6139 Remote Similarity NPD5777 Approved
0.6129 Remote Similarity NPD6882 Approved
0.6129 Remote Similarity NPD8078 Approved
0.6129 Remote Similarity NPD8297 Approved
0.6129 Remote Similarity NPD8077 Approved
0.6117 Remote Similarity NPD6942 Approved
0.6117 Remote Similarity NPD7339 Approved
0.6116 Remote Similarity NPD6614 Approved
0.6111 Remote Similarity NPD3527 Clinical (unspecified phase)
0.6111 Remote Similarity NPD4766 Approved
0.6111 Remote Similarity NPD7755 Approved
0.6111 Remote Similarity NPD7754 Approved
0.61 Remote Similarity NPD4137 Phase 3
0.6091 Remote Similarity NPD4690 Approved
0.6091 Remote Similarity NPD4689 Approved
0.6091 Remote Similarity NPD4693 Phase 3
0.6091 Remote Similarity NPD4138 Approved
0.6091 Remote Similarity NPD4688 Approved
0.6091 Remote Similarity NPD5205 Approved
0.6087 Remote Similarity NPD5210 Approved
0.6087 Remote Similarity NPD4629 Approved
0.6087 Remote Similarity NPD5654 Approved
0.6063 Remote Similarity NPD7115 Discovery
0.6053 Remote Similarity NPD5781 Clinical (unspecified phase)
0.604 Remote Similarity NPD4691 Approved
0.6034 Remote Similarity NPD5221 Approved
0.6034 Remote Similarity NPD5222 Approved
0.6034 Remote Similarity NPD5220 Clinical (unspecified phase)
0.6033 Remote Similarity NPD6920 Discontinued
0.6031 Remote Similarity NPD7604 Phase 2
0.6029 Remote Similarity NPD8338 Approved
0.6019 Remote Similarity NPD5733 Approved
0.6018 Remote Similarity NPD4096 Approved
0.6 Remote Similarity NPD3621 Clinical (unspecified phase)
0.6 Remote Similarity NPD6291 Clinical (unspecified phase)
0.5984 Remote Similarity NPD6868 Approved
0.5984 Remote Similarity NPD6412 Phase 2
0.5983 Remote Similarity NPD4755 Approved
0.5983 Remote Similarity NPD5959 Approved
0.5983 Remote Similarity NPD5173 Approved
0.5969 Remote Similarity NPD6065 Approved
0.5965 Remote Similarity NPD6411 Approved
0.5963 Remote Similarity NPD4788 Approved
0.5956 Remote Similarity NPD7260 Phase 2
0.5952 Remote Similarity NPD7094 Approved
0.5952 Remote Similarity NPD6858 Approved
0.5946 Remote Similarity NPD5280 Approved
0.5946 Remote Similarity NPD5690 Phase 2
0.5946 Remote Similarity NPD4694 Approved
0.5946 Remote Similarity NPD3574 Clinical (unspecified phase)
0.5943 Remote Similarity NPD3617 Approved
0.5935 Remote Similarity NPD6415 Discontinued
0.5929 Remote Similarity NPD6334 Approved
0.5929 Remote Similarity NPD6333 Approved
0.5905 Remote Similarity NPD3701 Clinical (unspecified phase)
0.5902 Remote Similarity NPD8040 Discontinued
0.5897 Remote Similarity NPD7614 Phase 1
0.5891 Remote Similarity NPD6335 Approved
0.5882 Remote Similarity NPD4700 Approved
0.5882 Remote Similarity NPD5285 Approved
0.5882 Remote Similarity NPD4696 Approved
0.5882 Remote Similarity NPD5286 Approved
0.5865 Remote Similarity NPD6113 Clinical (unspecified phase)
0.5865 Remote Similarity NPD7492 Approved
0.5865 Remote Similarity NPD4687 Approved
0.5865 Remote Similarity NPD4058 Approved
0.5862 Remote Similarity NPD5771 Approved
0.5859 Remote Similarity NPD6274 Approved
0.5857 Remote Similarity NPD6623 Phase 3
0.5847 Remote Similarity NPD7919 Phase 3
0.5847 Remote Similarity NPD7920 Phase 3
0.5846 Remote Similarity NPD7100 Approved
0.5846 Remote Similarity NPD7101 Approved
0.5833 Remote Similarity NPD7525 Registered
0.5833 Remote Similarity NPD5223 Approved
0.5827 Remote Similarity NPD8298 Phase 2
0.5827 Remote Similarity NPD2607 Approved
0.5827 Remote Similarity NPD4632 Approved
0.5826 Remote Similarity NPD7637 Suspended
0.5825 Remote Similarity NPD5276 Approved
0.5825 Remote Similarity NPD4243 Approved
0.5822 Remote Similarity NPD7487 Discontinued
0.5821 Remote Similarity NPD6616 Approved

Structure

External Identifiers

PubChem CID   442980
ChEMBL   CHEMBL1801972
ZINC  

Physicochemical Properties

Molecular Weight:  343.25
ALogP:  -0.2365
MLogP:  3.55
XLogP:  4.212
# Rotatable Bonds:  4
Polar Surface Area:  38.33
# H-Bond Aceptor:  3
# H-Bond Donor:  1
# Rings:  5
# Heavy Atoms:  25

Download Data

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