Natural Product: NPC477676

Natural Product ID:  NPC477676
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C25H32O6
Standard InCHIKey:  IPIYDMBLPWQZGB-MZXZQTHYSA-N
Standard InCHI:  InChI=1S/C25H32O6/c1-13-15-12-29-22(27)19(15)21(28-6)14-11-17-24(4)9-8-18(26)30-23(2,3)16(24)7-10-25(17,5)31-20(13)14/h16-17H,7-12H2,1-6H3/t16-,17+,24-,25-/m0/s1
Canonical SMILES:  COc1c2C[C@H]3[C@](Oc2c(c2c1C(=O)OC2)C)(C)CC[C@@H]1[C@]3(C)CCC(=O)OC1(C)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
NPO33623 Penicillium lividum Species Aspergillaceae Eukaryota isolated from superficial mycobiota of the brown alga Sargassum miyabei (Lazurnaya Bay, the Sea of Japan) PMID[24852445]
NPO29375 Penicillium thomii Species Aspergillaceae Eukaryota isolated from superficial mycobiota of the brown alga Sargassum miyabei (Lazurnaya Bay, the Sea of Japan) PMID[24852445]
NPO29375 Penicillium thomii Species Aspergillaceae Eukaryota Lazurnaya Bay, the Sea of Japan PMID[24852445]
NPO33623 Penicillium lividum Species Aspergillaceae Eukaryota Lazurnaya Bay, the Sea of Japan PMID[24852445]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT82 Cell Line MDA-MB-231 Homo sapiens IC50 < 10000 nM 24852445
NPT2 Others Unspecified IC50 < 10000 nM 24852445
NPT2 Others Unspecified Inhibition = 36.3 % 24852445
NPT2 Others Unspecified IC50 = 10 nM 24852445

  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 NPC477676 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
0.9662 High Similarity NPC477675
0.9658 High Similarity NPC477673
0.9658 High Similarity NPC477672
0.9527 High Similarity NPC477669
0.9463 High Similarity NPC477687
0.9463 High Similarity NPC477671
0.94 High Similarity NPC477674
0.8758 High Similarity NPC477670
0.8662 High Similarity NPC239118
0.8645 High Similarity NPC472799
0.8609 High Similarity NPC75694
0.8599 High Similarity NPC158542
0.8571 High Similarity NPC125465
0.8562 High Similarity NPC470359
0.8553 High Similarity NPC470357
0.8544 High Similarity NPC4950
0.8535 High Similarity NPC4547
0.8497 Intermediate Similarity NPC137296
0.8497 Intermediate Similarity NPC8817
0.8497 Intermediate Similarity NPC245757
0.8497 Intermediate Similarity NPC304351
0.8462 Intermediate Similarity NPC217447
0.8462 Intermediate Similarity NPC271681
0.8452 Intermediate Similarity NPC474660
0.8452 Intermediate Similarity NPC150928
0.8447 Intermediate Similarity NPC100849
0.8431 Intermediate Similarity NPC473927
0.8428 Intermediate Similarity NPC218818
0.8421 Intermediate Similarity NPC470932
0.8395 Intermediate Similarity NPC314653
0.8395 Intermediate Similarity NPC316262
0.8385 Intermediate Similarity NPC473022
0.8365 Intermediate Similarity NPC272196
0.8344 Intermediate Similarity NPC472621
0.8344 Intermediate Similarity NPC469818
0.8344 Intermediate Similarity NPC273483
0.8333 Intermediate Similarity NPC119929
0.8333 Intermediate Similarity NPC473466
0.8323 Intermediate Similarity NPC472661
0.8313 Intermediate Similarity NPC472617
0.8313 Intermediate Similarity NPC474373
0.8303 Intermediate Similarity NPC477573
0.8303 Intermediate Similarity NPC477571
0.8303 Intermediate Similarity NPC477572
0.8302 Intermediate Similarity NPC146211
0.8302 Intermediate Similarity NPC470625
0.8301 Intermediate Similarity NPC189650
0.8293 Intermediate Similarity NPC472622
0.8282 Intermediate Similarity NPC102372
0.828 Intermediate Similarity NPC473131
0.828 Intermediate Similarity NPC470675
0.828 Intermediate Similarity NPC473732
0.828 Intermediate Similarity NPC478148
0.8269 Intermediate Similarity NPC291049
0.8269 Intermediate Similarity NPC233267
0.8263 Intermediate Similarity NPC294149
0.8261 Intermediate Similarity NPC470810
0.8255 Intermediate Similarity NPC156967
0.8255 Intermediate Similarity NPC472599
0.8253 Intermediate Similarity NPC472620
0.825 Intermediate Similarity NPC196448
0.8247 Intermediate Similarity NPC294365
0.8247 Intermediate Similarity NPC117716
0.8247 Intermediate Similarity NPC470674
0.8247 Intermediate Similarity NPC470673
0.8235 Intermediate Similarity NPC471643
0.8235 Intermediate Similarity NPC472344
0.8235 Intermediate Similarity NPC475656
0.8235 Intermediate Similarity NPC471639
0.8235 Intermediate Similarity NPC475148
0.8228 Intermediate Similarity NPC87708
0.8228 Intermediate Similarity NPC477960
0.8228 Intermediate Similarity NPC477961
0.8228 Intermediate Similarity NPC477962
0.8228 Intermediate Similarity NPC475116
0.8221 Intermediate Similarity NPC29055
0.8221 Intermediate Similarity NPC173587
0.8221 Intermediate Similarity NPC208120
0.8217 Intermediate Similarity NPC202595
0.8217 Intermediate Similarity NPC158866
0.8214 Intermediate Similarity NPC324220
0.8214 Intermediate Similarity NPC312630
0.8205 Intermediate Similarity NPC105415
0.8205 Intermediate Similarity NPC37139
0.8205 Intermediate Similarity NPC472345
0.82 Intermediate Similarity NPC245058
0.82 Intermediate Similarity NPC470983
0.82 Intermediate Similarity NPC470982
0.8193 Intermediate Similarity NPC17219
0.8193 Intermediate Similarity NPC313717
0.8193 Intermediate Similarity NPC315306
0.8182 Intermediate Similarity NPC184702
0.8182 Intermediate Similarity NPC232936
0.8176 Intermediate Similarity NPC210942
0.8176 Intermediate Similarity NPC169990
0.8171 Intermediate Similarity NPC21016
0.8171 Intermediate Similarity NPC146584
0.817 Intermediate Similarity NPC297985
0.817 Intermediate Similarity NPC201820
0.817 Intermediate Similarity NPC111201
0.8165 Intermediate Similarity NPC133856
0.8165 Intermediate Similarity NPC149526
0.8165 Intermediate Similarity NPC72958
0.8165 Intermediate Similarity NPC232645
0.8165 Intermediate Similarity NPC474417
0.816 Intermediate Similarity NPC475106
0.8155 Intermediate Similarity NPC289147
0.8153 Intermediate Similarity NPC471114
0.8148 Intermediate Similarity NPC472618
0.8148 Intermediate Similarity NPC143050
0.8148 Intermediate Similarity NPC313368
0.8148 Intermediate Similarity NPC470358
0.8141 Intermediate Similarity NPC19747
0.8141 Intermediate Similarity NPC474108
0.8141 Intermediate Similarity NPC125801
0.8141 Intermediate Similarity NPC177995
0.8133 Intermediate Similarity NPC213416
0.8133 Intermediate Similarity NPC473202
0.8133 Intermediate Similarity NPC102810
0.8133 Intermediate Similarity NPC472619
0.8129 Intermediate Similarity NPC71184
0.8129 Intermediate Similarity NPC62799
0.8129 Intermediate Similarity NPC206212
0.8129 Intermediate Similarity NPC49282
0.8129 Intermediate Similarity NPC171656
0.8125 Intermediate Similarity NPC89625
0.8125 Intermediate Similarity NPC149618
0.8121 Intermediate Similarity NPC472452
0.8121 Intermediate Similarity NPC475109
0.8118 Intermediate Similarity NPC473729
0.8118 Intermediate Similarity NPC473607
0.8117 Intermediate Similarity NPC167663
0.8113 Intermediate Similarity NPC40356
0.8113 Intermediate Similarity NPC175978
0.8113 Intermediate Similarity NPC154683
0.811 Intermediate Similarity NPC156082
0.811 Intermediate Similarity NPC475055
0.8105 Intermediate Similarity NPC82920
0.8105 Intermediate Similarity NPC164697
0.8105 Intermediate Similarity NPC171094
0.8105 Intermediate Similarity NPC289660
0.8101 Intermediate Similarity NPC179178
0.8098 Intermediate Similarity NPC117985
0.8095 Intermediate Similarity NPC476311
0.8089 Intermediate Similarity NPC211625
0.8089 Intermediate Similarity NPC145467
0.8086 Intermediate Similarity NPC470339
0.8086 Intermediate Similarity NPC50430
0.8077 Intermediate Similarity NPC470676
0.8077 Intermediate Similarity NPC473135
0.8077 Intermediate Similarity NPC260946
0.8077 Intermediate Similarity NPC225173
0.8077 Intermediate Similarity NPC286038
0.8077 Intermediate Similarity NPC473132
0.8077 Intermediate Similarity NPC163846
0.8077 Intermediate Similarity NPC237208
0.8075 Intermediate Similarity NPC180924
0.8072 Intermediate Similarity NPC76647
0.8065 Intermediate Similarity NPC307895
0.8065 Intermediate Similarity NPC470553
0.8063 Intermediate Similarity NPC135522
0.8063 Intermediate Similarity NPC273248
0.8061 Intermediate Similarity NPC112981
0.8061 Intermediate Similarity NPC473286
0.8059 Intermediate Similarity NPC233978
0.8052 Intermediate Similarity NPC469579
0.8052 Intermediate Similarity NPC471640
0.8052 Intermediate Similarity NPC471644
0.8052 Intermediate Similarity NPC285659
0.8052 Intermediate Similarity NPC205071
0.8052 Intermediate Similarity NPC157497
0.8052 Intermediate Similarity NPC81337
0.805 Intermediate Similarity NPC290671
0.8049 Intermediate Similarity NPC108767
0.8049 Intermediate Similarity NPC472402
0.8047 Intermediate Similarity NPC162248
0.8039 Intermediate Similarity NPC472515
0.8039 Intermediate Similarity NPC270913
0.8039 Intermediate Similarity NPC473209
0.8038 Intermediate Similarity NPC164299
0.8038 Intermediate Similarity NPC303989
0.8038 Intermediate Similarity NPC158338
0.8038 Intermediate Similarity NPC288036
0.8038 Intermediate Similarity NPC474305
0.8038 Intermediate Similarity NPC100985
0.8038 Intermediate Similarity NPC97029
0.8038 Intermediate Similarity NPC97028
0.8038 Intermediate Similarity NPC65589
0.8037 Intermediate Similarity NPC47623
0.8037 Intermediate Similarity NPC472055
0.8036 Intermediate Similarity NPC118128
0.8026 Intermediate Similarity NPC38153
0.8025 Intermediate Similarity NPC66991
0.8025 Intermediate Similarity NPC282335
0.8025 Intermediate Similarity NPC308200
0.8025 Intermediate Similarity NPC164110
0.8025 Intermediate Similarity NPC263483
0.8025 Intermediate Similarity NPC246647
0.8025 Intermediate Similarity NPC123153
0.8025 Intermediate Similarity NPC212967

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC477676 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
0.8609 High Similarity NPD2533 Approved
0.8609 High Similarity NPD2532 Approved
0.8609 High Similarity NPD2534 Approved
0.8291 Intermediate Similarity NPD7819 Suspended
0.8049 Intermediate Similarity NPD5710 Approved
0.8049 Intermediate Similarity NPD5711 Approved
0.8039 Intermediate Similarity NPD2800 Approved
0.7927 Intermediate Similarity NPD5494 Approved
0.7879 Intermediate Similarity NPD6959 Discontinued
0.7799 Intermediate Similarity NPD920 Approved
0.7798 Intermediate Similarity NPD7473 Discontinued
0.7764 Intermediate Similarity NPD6599 Discontinued
0.7763 Intermediate Similarity NPD6651 Approved
0.7756 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7742 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7733 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.773 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7725 Intermediate Similarity NPD6232 Discontinued
0.7677 Intermediate Similarity NPD2346 Discontinued
0.7622 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.7613 Intermediate Similarity NPD6100 Approved
0.7613 Intermediate Similarity NPD6099 Approved
0.7613 Intermediate Similarity NPD2796 Approved
0.7607 Intermediate Similarity NPD7411 Suspended
0.7602 Intermediate Similarity NPD5844 Phase 1
0.759 Intermediate Similarity NPD3749 Approved
0.759 Intermediate Similarity NPD7075 Discontinued
0.758 Intermediate Similarity NPD1243 Approved
0.7576 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7562 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7562 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7545 Intermediate Similarity NPD5537 Clinical (unspecified phase)
0.7515 Intermediate Similarity NPD7229 Phase 3
0.7485 Intermediate Similarity NPD3226 Approved
0.747 Intermediate Similarity NPD3817 Phase 2
0.7455 Intermediate Similarity NPD6801 Discontinued
0.7438 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7436 Intermediate Similarity NPD2799 Discontinued
0.7436 Intermediate Similarity NPD3748 Approved
0.7425 Intermediate Similarity NPD7768 Phase 2
0.7391 Intermediate Similarity NPD6799 Approved
0.7371 Intermediate Similarity NPD6559 Discontinued
0.7349 Intermediate Similarity NPD1934 Approved
0.7346 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7346 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7342 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7342 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7337 Intermediate Similarity NPD919 Approved
0.7326 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7321 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.7296 Intermediate Similarity NPD1549 Phase 2
0.7273 Intermediate Similarity NPD7985 Registered
0.7273 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.726 Intermediate Similarity NPD7644 Approved
0.7229 Intermediate Similarity NPD4380 Phase 2
0.7219 Intermediate Similarity NPD3882 Suspended
0.7205 Intermediate Similarity NPD4628 Phase 3
0.7205 Intermediate Similarity NPD3750 Approved
0.7202 Intermediate Similarity NPD1465 Phase 2
0.7202 Intermediate Similarity NPD2801 Approved
0.7198 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.717 Intermediate Similarity NPD1551 Phase 2
0.717 Intermediate Similarity NPD2935 Discontinued
0.7169 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7167 Intermediate Similarity NPD8434 Phase 2
0.7151 Intermediate Similarity NPD1247 Approved
0.7143 Intermediate Similarity NPD7893 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD6832 Phase 2
0.7143 Intermediate Similarity NPD3818 Discontinued
0.7143 Intermediate Similarity NPD37 Approved
0.7134 Intermediate Similarity NPD5124 Phase 1
0.7134 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7118 Intermediate Similarity NPD4965 Approved
0.7118 Intermediate Similarity NPD4967 Phase 2
0.7118 Intermediate Similarity NPD4966 Approved
0.7115 Intermediate Similarity NPD8032 Phase 2
0.7107 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7107 Intermediate Similarity NPD1510 Phase 2
0.7102 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7102 Intermediate Similarity NPD7286 Phase 2
0.7101 Intermediate Similarity NPD5760 Phase 2
0.7101 Intermediate Similarity NPD5761 Phase 2
0.7095 Intermediate Similarity NPD8312 Approved
0.7095 Intermediate Similarity NPD8313 Approved
0.7091 Intermediate Similarity NPD6273 Approved
0.7089 Intermediate Similarity NPD1607 Approved
0.7076 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7073 Intermediate Similarity NPD1511 Approved
0.707 Intermediate Similarity NPD2979 Phase 3
0.7069 Intermediate Similarity NPD3926 Phase 2
0.7062 Intermediate Similarity NPD7074 Phase 3
0.7059 Intermediate Similarity NPD5402 Approved
0.7052 Intermediate Similarity NPD7199 Phase 2
0.7051 Intermediate Similarity NPD6410 Clinical (unspecified phase)
0.7051 Intermediate Similarity NPD2313 Discontinued
0.7048 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7035 Intermediate Similarity NPD6234 Discontinued
0.7029 Intermediate Similarity NPD6166 Phase 2
0.7029 Intermediate Similarity NPD2403 Approved
0.7029 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7029 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7025 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7006 Intermediate Similarity NPD7054 Approved
0.6994 Remote Similarity NPD7003 Approved
0.6988 Remote Similarity NPD1512 Approved
0.6982 Remote Similarity NPD7615 Clinical (unspecified phase)
0.6971 Remote Similarity NPD7184 Clinical (unspecified phase)
0.697 Remote Similarity NPD7390 Discontinued
0.6968 Remote Similarity NPD8285 Discontinued
0.6966 Remote Similarity NPD7472 Approved
0.6964 Remote Similarity NPD7458 Discontinued
0.6962 Remote Similarity NPD1240 Approved
0.6949 Remote Similarity NPD7228 Approved
0.6944 Remote Similarity NPD4338 Clinical (unspecified phase)
0.6944 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6933 Remote Similarity NPD5691 Approved
0.6927 Remote Similarity NPD5953 Discontinued
0.6927 Remote Similarity NPD7993 Clinical (unspecified phase)
0.6923 Remote Similarity NPD8055 Clinical (unspecified phase)
0.6914 Remote Similarity NPD1471 Phase 3
0.6914 Remote Similarity NPD2343 Clinical (unspecified phase)
0.6908 Remote Similarity NPD1281 Approved
0.689 Remote Similarity NPD7982 Clinical (unspecified phase)
0.689 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6889 Remote Similarity NPD7251 Discontinued
0.6887 Remote Similarity NPD17 Approved
0.6887 Remote Similarity NPD3412 Clinical (unspecified phase)
0.6885 Remote Similarity NPD8150 Discontinued
0.6879 Remote Similarity NPD4625 Phase 3
0.686 Remote Similarity NPD5353 Approved
0.6855 Remote Similarity NPD4307 Phase 2
0.6852 Remote Similarity NPD5408 Approved
0.6852 Remote Similarity NPD5405 Approved
0.6852 Remote Similarity NPD2438 Suspended
0.6852 Remote Similarity NPD5406 Approved
0.6852 Remote Similarity NPD5404 Approved
0.6851 Remote Similarity NPD7808 Phase 3
0.6845 Remote Similarity NPD5403 Approved
0.6837 Remote Similarity NPD7782 Clinical (unspecified phase)
0.6837 Remote Similarity NPD7783 Phase 2
0.6833 Remote Similarity NPD6797 Phase 2
0.6829 Remote Similarity NPD2654 Approved
0.6826 Remote Similarity NPD5401 Approved
0.6823 Remote Similarity NPD7435 Discontinued
0.6821 Remote Similarity NPD8151 Discontinued
0.6811 Remote Similarity NPD4287 Approved
0.6811 Remote Similarity NPD8397 Clinical (unspecified phase)
0.6796 Remote Similarity NPD7240 Approved
0.679 Remote Similarity NPD7033 Discontinued
0.6782 Remote Similarity NPD8366 Approved
0.6774 Remote Similarity NPD1283 Approved
0.6774 Remote Similarity NPD6696 Suspended
0.6761 Remote Similarity NPD8127 Discontinued
0.676 Remote Similarity NPD7177 Discontinued
0.6753 Remote Similarity NPD3972 Approved
0.6753 Remote Similarity NPD1608 Approved
0.6748 Remote Similarity NPD4476 Approved
0.6748 Remote Similarity NPD4477 Approved
0.6748 Remote Similarity NPD2531 Phase 2
0.6733 Remote Similarity NPD7340 Approved
0.6731 Remote Similarity NPD3267 Approved
0.6731 Remote Similarity NPD3266 Approved
0.673 Remote Similarity NPD1296 Phase 2
0.673 Remote Similarity NPD4907 Clinical (unspecified phase)
0.673 Remote Similarity NPD3764 Approved
0.6727 Remote Similarity NPD6674 Discontinued
0.6723 Remote Similarity NPD3787 Discontinued
0.671 Remote Similarity NPD4749 Approved
0.6708 Remote Similarity NPD1933 Approved
0.6708 Remote Similarity NPD230 Phase 1
0.6707 Remote Similarity NPD6004 Phase 3
0.6707 Remote Similarity NPD6002 Phase 3
0.6707 Remote Similarity NPD6006 Clinical (unspecified phase)
0.6707 Remote Similarity NPD2344 Approved
0.6707 Remote Similarity NPD6005 Phase 3
0.6707 Remote Similarity NPD6003 Clinical (unspecified phase)
0.6688 Remote Similarity NPD1547 Clinical (unspecified phase)
0.6688 Remote Similarity NPD1019 Discontinued
0.6688 Remote Similarity NPD6917 Clinical (unspecified phase)
0.6687 Remote Similarity NPD4308 Phase 3
0.6686 Remote Similarity NPD5889 Approved
0.6686 Remote Similarity NPD5890 Approved
0.6685 Remote Similarity NPD5242 Approved
0.6667 Remote Similarity NPD6777 Approved
0.6667 Remote Similarity NPD7837 Clinical (unspecified phase)
0.6667 Remote Similarity NPD6781 Approved
0.6667 Remote Similarity NPD6780 Approved
0.6667 Remote Similarity NPD4626 Approved
0.6667 Remote Similarity NPD6779 Approved
0.6667 Remote Similarity NPD6778 Approved
0.6667 Remote Similarity NPD1778 Approved
0.6667 Remote Similarity NPD4288 Approved
0.6667 Remote Similarity NPD7501 Clinical (unspecified phase)
0.6667 Remote Similarity NPD3751 Discontinued
0.6667 Remote Similarity NPD6782 Approved
0.6667 Remote Similarity NPD6776 Approved
0.665 Remote Similarity NPD8491 Approved
0.6649 Remote Similarity NPD7697 Approved
0.6649 Remote Similarity NPD7696 Phase 3

Structure

External Identifiers

PubChem CID  
ChEMBL   CHEMBL3310796
ZINC  

Physicochemical Properties

Molecular Weight:  428.22
ALogP:  2.1474
MLogP:  3.55
XLogP:  4.596
# Rotatable Bonds:  7
Polar Surface Area:  71.06
# H-Bond Aceptor:  4
# H-Bond Donor:  0
# Rings:  5
# Heavy Atoms:  31

Download Data

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