Natural Product: NPC244336

Natural Product ID:  NPC244336
Common Name:   Nostocyclopeptide A2
IUPAC Name:  
Synonyms:   nostocyclopeptide A2
Molecular Formula:   C40H54N8O9
Standard InCHIKey:  OYHPNVXZUBWKJE-ZYAMHZMNSA-N
Standard InCHI:  InChI=1S/C40H54N8O9/c1-4-24(3)35-39(56)46-31(22-49)40(57)48-21-23(2)16-32(48)38(55)44-27(17-25-8-6-5-7-9-25)19-42-30(18-26-10-12-28(50)13-11-26)36(53)43-20-34(52)45-29(37(54)47-35)14-15-33(41)51/h5-13,19,23-24,27,29-32,35,49-50H,4,14-18,20-22H2,1-3H3,(H2,41,51)(H,43,53)(H,44,55)(H,45,52)(H,46,56)(H,47,54)/b42-19+/t23-,24-,27-,29+,30-,31-,32-,35-/m0/s1
Canonical SMILES:  CC[C@@H]([C@@H]1N=C(O)[C@@H](CCC(=N)O)N=C(O)CN=C(O)[C@@H](/N=C/[C@@H](N=C([C@H]2N(C(=O)[C@@H](N=C1O)CO)C[C@H](C2)C)O)Cc1ccccc1)Cc1ccc(cc1)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
NPO9705 Meyerozyma guilliermondii Species Debaryomycetaceae Eukaryota UNPD*
NPO3613 Eriobotrya deflexa Species Rosaceae Eukaryota UNPD*
NPO5335 Nostoc sp Species Nostocaceae Bacteria UNPD*
NPO8811 Cytisus prolifer Species Fabaceae Eukaryota UNPD*
NPO8945 Grevillea robusta Species Proteaceae Eukaryota UNPD*
NPO1969 Streptomyces pilosus Species Streptomycetaceae Bacteria UNPD*
NPO28833 Eleutherococcus sieboldianus Species Araliaceae Eukaryota UNPD*
NPO4541 Capnella lacertiliensis Species Nephtheidae Eukaryota UNPD*
NPO23436 Cladrastis sikokiana Species Fabaceae Eukaryota UNPD*
NPO7240 Osteospermum oppositifolium Species Asteraceae Eukaryota UNPD*
NPO834 Peperomia clusiifolia Species Piperaceae Eukaryota UNPD*
NPO8305 Katsuwonus pelamis Species Scombridae Eukaryota UNPD*
NPO19541 Smilax moranensis Species Smilacaceae Eukaryota UNPD*
NPO19804 Lycopodium saururus Species Lycopodiaceae Eukaryota UNPD*
NPO10879 Lasius meridionalis Species Formicidae Eukaryota UNPD*
NPO18618 Neurolaena lobata Species Asteraceae Eukaryota UNPD*
NPO8623 Anneissia japonica Species Comatulidae Eukaryota UNPD*
NPO4198 Ungernia vvedenskyi Species Amaryllidaceae Eukaryota UNPD*
NPO8426 Tinospora rumphii Species Menispermaceae Eukaryota UNPD*
NPO7788 Rana catesbeiana Species Ranidae Eukaryota UNPD*
NPO12744 Ajuga nipponensis Species Lamiaceae Eukaryota UNPD*
NPO1537 Vaccinium arctostaphylos Species Ericaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT91 Cell Line KB Homo sapiens IC50 = 1000 nM 11170666
NPT114 Cell Line LoVo Homo sapiens IC50 = 1000 nM 11170666
NPT2 Others Unspecified IC50 < 50000 nM 11170666
NPT670 Individual Protein Thrombin Homo sapiens IC50 < 50000 nM 11170666
NPT1720 Individual Protein Plasminogen Homo sapiens IC50 < 50000 nM 11170666
NPT2 Others Unspecified IC50 < 25000 nM 11170666
NPT201 Individual Protein Papain Carica papaya IC50 < 25000 nM 11170666

  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 NPC244336 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
0.9793 High Similarity NPC244509
0.9517 High Similarity NPC473491
0.8966 High Similarity NPC476989
0.8874 High Similarity NPC56685
0.8812 High Similarity NPC471165
0.8792 High Similarity NPC16188
0.879 High Similarity NPC61004
0.8766 High Similarity NPC323336
0.8766 High Similarity NPC326349
0.875 High Similarity NPC202198
0.8734 High Similarity NPC328649
0.8718 High Similarity NPC241794
0.8688 High Similarity NPC328494
0.8636 High Similarity NPC476268
0.8627 High Similarity NPC262166
0.8625 High Similarity NPC475204
0.8625 High Similarity NPC475123
0.858 High Similarity NPC136797
0.85 High Similarity NPC302597
0.8442 Intermediate Similarity NPC233702
0.8405 Intermediate Similarity NPC306804
0.8405 Intermediate Similarity NPC137627
0.8387 Intermediate Similarity NPC261934
0.8387 Intermediate Similarity NPC5194
0.8375 Intermediate Similarity NPC63931
0.8354 Intermediate Similarity NPC26108
0.8344 Intermediate Similarity NPC89831
0.8303 Intermediate Similarity NPC50016
0.8293 Intermediate Similarity NPC273755
0.8282 Intermediate Similarity NPC46009
0.8272 Intermediate Similarity NPC107938
0.8272 Intermediate Similarity NPC294516
0.8242 Intermediate Similarity NPC17698
0.8242 Intermediate Similarity NPC158277
0.8232 Intermediate Similarity NPC230611
0.8221 Intermediate Similarity NPC280022
0.8204 Intermediate Similarity NPC45037
0.8204 Intermediate Similarity NPC194671
0.8204 Intermediate Similarity NPC269750
0.8182 Intermediate Similarity NPC475532
0.8171 Intermediate Similarity NPC40234
0.816 Intermediate Similarity NPC141957
0.8133 Intermediate Similarity NPC476227
0.8133 Intermediate Similarity NPC165285
0.8133 Intermediate Similarity NPC473402
0.8107 Intermediate Similarity NPC477637
0.8098 Intermediate Similarity NPC254700
0.8095 Intermediate Similarity NPC97526
0.8095 Intermediate Similarity NPC119652
0.8079 Intermediate Similarity NPC242159
0.8079 Intermediate Similarity NPC313694
0.8072 Intermediate Similarity NPC248670
0.8024 Intermediate Similarity NPC155506
0.8024 Intermediate Similarity NPC279871
0.8024 Intermediate Similarity NPC159767
0.8011 Intermediate Similarity NPC477638
0.8011 Intermediate Similarity NPC477632
0.8 Intermediate Similarity NPC129486
0.7966 Intermediate Similarity NPC329295
0.7963 Intermediate Similarity NPC469243
0.7952 Intermediate Similarity NPC198254
0.7952 Intermediate Similarity NPC274198
0.7935 Intermediate Similarity NPC266741
0.7933 Intermediate Similarity NPC287401
0.7917 Intermediate Similarity NPC473354
0.7895 Intermediate Similarity NPC473404
0.7885 Intermediate Similarity NPC81026
0.7874 Intermediate Similarity NPC94862
0.7853 Intermediate Similarity NPC475544
0.7844 Intermediate Similarity NPC276506
0.7831 Intermediate Similarity NPC209463
0.7818 Intermediate Similarity NPC223207
0.7791 Intermediate Similarity NPC319320
0.7791 Intermediate Similarity NPC287757
0.7784 Intermediate Similarity NPC240130
0.7784 Intermediate Similarity NPC61332
0.7784 Intermediate Similarity NPC477636
0.7771 Intermediate Similarity NPC471771
0.7771 Intermediate Similarity NPC304074
0.7771 Intermediate Similarity NPC290755
0.7765 Intermediate Similarity NPC196243
0.7742 Intermediate Similarity NPC197921
0.7716 Intermediate Similarity NPC473580
0.7701 Intermediate Similarity NPC294951
0.7697 Intermediate Similarity NPC477631
0.7692 Intermediate Similarity NPC91953
0.7692 Intermediate Similarity NPC469360
0.7688 Intermediate Similarity NPC476321
0.7687 Intermediate Similarity NPC46427
0.7671 Intermediate Similarity NPC202521
0.7662 Intermediate Similarity NPC64205
0.7654 Intermediate Similarity NPC65714
0.7651 Intermediate Similarity NPC133470
0.7651 Intermediate Similarity NPC289776
0.7651 Intermediate Similarity NPC191863
0.7647 Intermediate Similarity NPC141050
0.7644 Intermediate Similarity NPC471526
0.7633 Intermediate Similarity NPC471568
0.7633 Intermediate Similarity NPC473693
0.7632 Intermediate Similarity NPC326966
0.763 Intermediate Similarity NPC475409
0.763 Intermediate Similarity NPC475564
0.763 Intermediate Similarity NPC170302
0.7619 Intermediate Similarity NPC252878
0.7614 Intermediate Similarity NPC276120
0.7605 Intermediate Similarity NPC472923
0.7603 Intermediate Similarity NPC476990
0.76 Intermediate Similarity NPC319766
0.7593 Intermediate Similarity NPC122590
0.7582 Intermediate Similarity NPC477552
0.7582 Intermediate Similarity NPC477550
0.7572 Intermediate Similarity NPC475421
0.7571 Intermediate Similarity NPC96275
0.7569 Intermediate Similarity NPC473371
0.7569 Intermediate Similarity NPC477639
0.7568 Intermediate Similarity NPC6975
0.7566 Intermediate Similarity NPC255447
0.7564 Intermediate Similarity NPC214988
0.7557 Intermediate Similarity NPC299806
0.7556 Intermediate Similarity NPC302715
0.7556 Intermediate Similarity NPC328763
0.7547 Intermediate Similarity NPC314358
0.7546 Intermediate Similarity NPC39431
0.7529 Intermediate Similarity NPC153554
0.7528 Intermediate Similarity NPC102959
0.7527 Intermediate Similarity NPC471592
0.7516 Intermediate Similarity NPC257390
0.7514 Intermediate Similarity NPC473546
0.75 Intermediate Similarity NPC471050
0.75 Intermediate Similarity NPC477551
0.75 Intermediate Similarity NPC471048
0.75 Intermediate Similarity NPC471049
0.7486 Intermediate Similarity NPC60516
0.7486 Intermediate Similarity NPC473305
0.7486 Intermediate Similarity NPC51047
0.7486 Intermediate Similarity NPC163961
0.7484 Intermediate Similarity NPC316008
0.7484 Intermediate Similarity NPC313867
0.7469 Intermediate Similarity NPC324081
0.7469 Intermediate Similarity NPC475168
0.7469 Intermediate Similarity NPC7817
0.7468 Intermediate Similarity NPC251439
0.7458 Intermediate Similarity NPC138083
0.7458 Intermediate Similarity NPC315542
0.7451 Intermediate Similarity NPC130309
0.7443 Intermediate Similarity NPC470903
0.7443 Intermediate Similarity NPC470112
0.7443 Intermediate Similarity NPC167763
0.7439 Intermediate Similarity NPC470902
0.7427 Intermediate Similarity NPC196091
0.7421 Intermediate Similarity NPC315283
0.7421 Intermediate Similarity NPC314388
0.7419 Intermediate Similarity NPC267237
0.7415 Intermediate Similarity NPC283760
0.7407 Intermediate Similarity NPC2501
0.7391 Intermediate Similarity NPC323662
0.7379 Intermediate Similarity NPC317254
0.7368 Intermediate Similarity NPC186617
0.7358 Intermediate Similarity NPC168861
0.7348 Intermediate Similarity NPC473407
0.7348 Intermediate Similarity NPC473378
0.7347 Intermediate Similarity NPC470546
0.7342 Intermediate Similarity NPC322526
0.7333 Intermediate Similarity NPC246591
0.733 Intermediate Similarity NPC32064
0.7329 Intermediate Similarity NPC470544
0.732 Intermediate Similarity NPC111428
0.7312 Intermediate Similarity NPC52748
0.7299 Intermediate Similarity NPC477462
0.7299 Intermediate Similarity NPC164608
0.7293 Intermediate Similarity NPC283207
0.7285 Intermediate Similarity NPC307020
0.7279 Intermediate Similarity NPC470545
0.7278 Intermediate Similarity NPC473055
0.7278 Intermediate Similarity NPC473052
0.7273 Intermediate Similarity NPC473341
0.7273 Intermediate Similarity NPC300315
0.7273 Intermediate Similarity NPC325651
0.7267 Intermediate Similarity NPC209509
0.7267 Intermediate Similarity NPC474862
0.7256 Intermediate Similarity NPC476743
0.7253 Intermediate Similarity NPC470728
0.7253 Intermediate Similarity NPC248822
0.7248 Intermediate Similarity NPC200964
0.7244 Intermediate Similarity NPC244866
0.7244 Intermediate Similarity NPC328070
0.7233 Intermediate Similarity NPC476259
0.7228 Intermediate Similarity NPC80514
0.7215 Intermediate Similarity NPC471264
0.7215 Intermediate Similarity NPC6570
0.7215 Intermediate Similarity NPC471265
0.7212 Intermediate Similarity NPC476744
0.7212 Intermediate Similarity NPC162104
0.7209 Intermediate Similarity NPC473502
0.7208 Intermediate Similarity NPC469666
0.7208 Intermediate Similarity NPC473322
0.7205 Intermediate Similarity NPC476978
0.7202 Intermediate Similarity NPC324850
0.7197 Intermediate Similarity NPC248283
0.7162 Intermediate Similarity NPC38458

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC244336 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
0.8526 High Similarity NPD7118 Clinical (unspecified phase)
0.8098 Intermediate Similarity NPD8303 Discontinued
0.7862 Intermediate Similarity NPD7303 Discontinued
0.7806 Intermediate Similarity NPD7978 Discontinued
0.7692 Intermediate Similarity NPD5137 Approved
0.7548 Intermediate Similarity NPD8173 Phase 2
0.7548 Intermediate Similarity NPD8172 Phase 2
0.7516 Intermediate Similarity NPD7450 Phase 2
0.7485 Intermediate Similarity NPD7131 Phase 3
0.7484 Intermediate Similarity NPD6860 Clinical (unspecified phase)
0.7468 Intermediate Similarity NPD5729 Clinical (unspecified phase)
0.7451 Intermediate Similarity NPD3136 Phase 2
0.7438 Intermediate Similarity NPD6676 Phase 2
0.7427 Intermediate Similarity NPD4652 Approved
0.7423 Intermediate Similarity NPD7613 Discontinued
0.7396 Intermediate Similarity NPD2098 Approved
0.7368 Intermediate Similarity NPD7485 Phase 3
0.7368 Intermediate Similarity NPD7484 Phase 3
0.7365 Intermediate Similarity NPD7495 Discontinued
0.7365 Intermediate Similarity NPD8019 Approved
0.7333 Intermediate Similarity NPD2562 Approved
0.7333 Intermediate Similarity NPD2561 Approved
0.7293 Intermediate Similarity NPD7617 Discontinued
0.7285 Intermediate Similarity NPD4659 Approved
0.7278 Intermediate Similarity NPD2097 Approved
0.7273 Intermediate Similarity NPD7523 Phase 3
0.7255 Intermediate Similarity NPD7451 Discontinued
0.7233 Intermediate Similarity NPD7728 Clinical (unspecified phase)
0.7233 Intermediate Similarity NPD6867 Clinical (unspecified phase)
0.7233 Intermediate Similarity NPD6866 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD7608 Discontinued
0.719 Intermediate Similarity NPD4104 Clinical (unspecified phase)
0.719 Intermediate Similarity NPD4103 Phase 2
0.717 Intermediate Similarity NPD3552 Approved
0.717 Intermediate Similarity NPD3554 Approved
0.717 Intermediate Similarity NPD3553 Approved
0.717 Intermediate Similarity NPD3555 Approved
0.7152 Intermediate Similarity NPD7113 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD5339 Clinical (unspecified phase)
0.7107 Intermediate Similarity NPD2568 Approved
0.7102 Intermediate Similarity NPD5200 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD8031 Discontinued
0.7089 Intermediate Similarity NPD6346 Approved
0.7074 Intermediate Similarity NPD7811 Phase 3
0.7074 Intermediate Similarity NPD7810 Phase 3
0.707 Intermediate Similarity NPD1330 Phase 2
0.707 Intermediate Similarity NPD1329 Clinical (unspecified phase)
0.7069 Intermediate Similarity NPD2890 Approved
0.7069 Intermediate Similarity NPD2889 Approved
0.7069 Intermediate Similarity NPD2017 Approved
0.7069 Intermediate Similarity NPD2888 Approved
0.702 Intermediate Similarity NPD5238 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD5773 Approved
0.7018 Intermediate Similarity NPD5772 Approved
0.7012 Intermediate Similarity NPD3400 Discontinued
0.7012 Intermediate Similarity NPD7066 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD5314 Approved
0.6988 Remote Similarity NPD6682 Clinical (unspecified phase)
0.6983 Remote Similarity NPD7695 Clinical (unspecified phase)
0.6933 Remote Similarity NPD856 Approved
0.6933 Remote Similarity NPD317 Approved
0.6933 Remote Similarity NPD6809 Clinical (unspecified phase)
0.6933 Remote Similarity NPD16 Approved
0.6933 Remote Similarity NPD318 Approved
0.6905 Remote Similarity NPD6078 Clinical (unspecified phase)
0.6887 Remote Similarity NPD5304 Approved
0.6887 Remote Similarity NPD5303 Approved
0.6875 Remote Similarity NPD3059 Approved
0.6875 Remote Similarity NPD3061 Approved
0.6875 Remote Similarity NPD3062 Approved
0.6875 Remote Similarity NPD8416 Discontinued
0.6863 Remote Similarity NPD3421 Phase 3
0.6845 Remote Similarity NPD2874 Phase 2
0.6832 Remote Similarity NPD8643 Discontinued
0.6829 Remote Similarity NPD8076 Discontinued
0.6824 Remote Similarity NPD6670 Clinical (unspecified phase)
0.6813 Remote Similarity NPD5745 Approved
0.6813 Remote Similarity NPD6405 Approved
0.6813 Remote Similarity NPD6407 Approved
0.6807 Remote Similarity NPD5481 Discontinued
0.6795 Remote Similarity NPD3125 Approved
0.6792 Remote Similarity NPD6919 Clinical (unspecified phase)
0.679 Remote Similarity NPD3052 Approved
0.679 Remote Similarity NPD3054 Approved
0.6788 Remote Similarity NPD6681 Discovery
0.6782 Remote Similarity NPD7080 Clinical (unspecified phase)
0.6779 Remote Similarity NPD2228 Approved
0.6779 Remote Similarity NPD2234 Approved
0.6779 Remote Similarity NPD2229 Approved
0.6776 Remote Similarity NPD7132 Clinical (unspecified phase)
0.6766 Remote Similarity NPD7910 Clinical (unspecified phase)
0.6766 Remote Similarity NPD8323 Discontinued
0.6763 Remote Similarity NPD7011 Discontinued
0.6752 Remote Similarity NPD3053 Approved
0.6752 Remote Similarity NPD3055 Approved
0.675 Remote Similarity NPD598 Approved
0.675 Remote Similarity NPD601 Approved
0.675 Remote Similarity NPD597 Approved
0.6747 Remote Similarity NPD2460 Phase 3
0.6747 Remote Similarity NPD2458 Approved
0.6747 Remote Similarity NPD2459 Approved
0.6733 Remote Similarity NPD8405 Clinical (unspecified phase)
0.6726 Remote Similarity NPD6884 Clinical (unspecified phase)
0.6726 Remote Similarity NPD8290 Clinical (unspecified phase)
0.6725 Remote Similarity NPD8315 Phase 1
0.672 Remote Similarity NPD6089 Clinical (unspecified phase)
0.6708 Remote Similarity NPD1132 Approved
0.6708 Remote Similarity NPD1130 Approved
0.6708 Remote Similarity NPD1136 Approved
0.6688 Remote Similarity NPD5310 Approved
0.6688 Remote Similarity NPD5311 Approved
0.6687 Remote Similarity NPD4497 Clinical (unspecified phase)
0.6687 Remote Similarity NPD5746 Approved
0.6687 Remote Similarity NPD4782 Clinical (unspecified phase)
0.6686 Remote Similarity NPD7892 Clinical (unspecified phase)
0.6667 Remote Similarity NPD4791 Clinical (unspecified phase)
0.6667 Remote Similarity NPD8265 Approved
0.6667 Remote Similarity NPD4227 Discontinued
0.6667 Remote Similarity NPD2584 Suspended
0.6667 Remote Similarity NPD316 Approved
0.6649 Remote Similarity NPD7281 Phase 3
0.6649 Remote Similarity NPD7280 Phase 3
0.6648 Remote Similarity NPD42 Phase 2
0.6648 Remote Similarity NPD6020 Phase 2
0.6648 Remote Similarity NPD6042 Phase 2
0.6647 Remote Similarity NPD5348 Clinical (unspecified phase)
0.6647 Remote Similarity NPD3536 Discontinued
0.6647 Remote Similarity NPD3060 Approved
0.6647 Remote Similarity NPD3985 Discontinued
0.6647 Remote Similarity NPD7019 Approved
0.6647 Remote Similarity NPD7020 Approved
0.6646 Remote Similarity NPD1135 Approved
0.6646 Remote Similarity NPD1134 Approved
0.6646 Remote Similarity NPD1131 Approved
0.6646 Remote Similarity NPD1129 Approved
0.6646 Remote Similarity NPD2585 Clinical (unspecified phase)
0.6646 Remote Similarity NPD1133 Approved
0.6645 Remote Similarity NPD3123 Discovery
0.663 Remote Similarity NPD5192 Clinical (unspecified phase)
0.6627 Remote Similarity NPD6667 Approved
0.6627 Remote Similarity NPD6666 Approved
0.6625 Remote Similarity NPD7979 Clinical (unspecified phase)
0.6624 Remote Similarity NPD3676 Clinical (unspecified phase)
0.6614 Remote Similarity NPD5525 Clinical (unspecified phase)
0.6613 Remote Similarity NPD6851 Approved
0.6613 Remote Similarity NPD6853 Approved
0.6613 Remote Similarity NPD5946 Clinical (unspecified phase)
0.6612 Remote Similarity NPD5485 Approved
0.6612 Remote Similarity NPD5484 Approved
0.661 Remote Similarity NPD5218 Approved
0.661 Remote Similarity NPD5219 Approved
0.6609 Remote Similarity NPD6072 Discontinued
0.6604 Remote Similarity NPD599 Approved
0.6604 Remote Similarity NPD602 Approved
0.6603 Remote Similarity NPD5351 Clinical (unspecified phase)
0.6603 Remote Similarity NPD5350 Clinical (unspecified phase)
0.6601 Remote Similarity NPD9615 Approved
0.6601 Remote Similarity NPD9616 Approved
0.6601 Remote Similarity NPD9613 Approved
0.6595 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6591 Remote Similarity NPD3556 Approved
0.6591 Remote Similarity NPD3558 Approved
0.6591 Remote Similarity NPD3560 Approved
0.6591 Remote Similarity NPD5967 Approved
0.6591 Remote Similarity NPD7494 Clinical (unspecified phase)
0.6591 Remote Similarity NPD3557 Approved
0.6591 Remote Similarity NPD3559 Clinical (unspecified phase)
0.659 Remote Similarity NPD6523 Clinical (unspecified phase)
0.6587 Remote Similarity NPD5341 Clinical (unspecified phase)
0.6585 Remote Similarity NPD817 Approved
0.6585 Remote Similarity NPD6073 Approved
0.6585 Remote Similarity NPD823 Approved
0.6576 Remote Similarity NPD6297 Approved
0.6568 Remote Similarity NPD8131 Suspended
0.6566 Remote Similarity NPD6897 Clinical (unspecified phase)
0.6564 Remote Similarity NPD6254 Approved
0.6564 Remote Similarity NPD6256 Approved
0.6564 Remote Similarity NPD6255 Approved
0.6548 Remote Similarity NPD4236 Phase 3
0.6548 Remote Similarity NPD4237 Approved
0.6548 Remote Similarity NPD3638 Discontinued
0.6545 Remote Similarity NPD6901 Phase 3
0.6543 Remote Similarity NPD3056 Clinical (unspecified phase)
0.6534 Remote Similarity NPD2978 Approved
0.6534 Remote Similarity NPD2977 Approved
0.6529 Remote Similarity NPD7554 Discontinued
0.6522 Remote Similarity NPD5263 Approved
0.6522 Remote Similarity NPD4125 Approved
0.6519 Remote Similarity NPD8051 Clinical (unspecified phase)
0.6517 Remote Similarity NPD4521 Clinical (unspecified phase)
0.6516 Remote Similarity NPD4093 Discontinued
0.6513 Remote Similarity NPD6253 Approved
0.6512 Remote Similarity NPD4186 Clinical (unspecified phase)
0.651 Remote Similarity NPD9380 Clinical (unspecified phase)
0.6508 Remote Similarity NPD4157 Discontinued
0.6503 Remote Similarity NPD7086 Phase 2
0.6503 Remote Similarity NPD8022 Clinical (unspecified phase)
0.6503 Remote Similarity NPD1423 Approved
0.6503 Remote Similarity NPD2245 Discovery
0.65 Remote Similarity NPD9619 Approved

Structure

External Identifiers

PubChem CID  
ChEMBL   CHEMBL506743
ZINC  

Physicochemical Properties

Molecular Weight:  790.40
ALogP:  -3.0431
MLogP:  3.99
XLogP:  4.182
# Rotatable Bonds:  21
Polar Surface Area:  280.16
# H-Bond Aceptor:  16
# H-Bond Donor:  9
# Rings:  4
# Heavy Atoms:  57

Download Data

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