Natural Product: NPC69360

Natural Product ID:  NPC69360
Common Name:   (+)-Lycoricidine
IUPAC Name:   (2S,3R,4S,4aR)-2,3,4-trihydroxy-3,4,4a,5-tetrahydro-2H-[1,3]dioxolo[4,5-j]phenanthridin-6-one
Synonyms:   7-Deoxynarciclasine
Molecular Formula:   C14H13NO6
Standard InCHIKey:  YYDLFVZOIDOGSO-KKBFJBPOSA-N
Standard InCHI:  InChI=1S/C14H13NO6/c16-8-1-6-5-2-9-10(21-4-20-9)3-7(5)14(19)15-11(6)13(18)12(8)17/h1-3,8,11-13,16-18H,4H2,(H,15,19)/t8-,11+,12+,13-/m0/s1
Canonical SMILES:  O[C@H]1C=C2[C@H]([C@@H]([C@@H]1O)O)N=C(c1c2cc2OCOc2c1)O
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
NPO32739 pancratium littorale Species Amaryllidaceae Eukaryota PMID[1336040]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT4330 Organism Sandfly fever sicilian virus Sandfly fever sicilian virus IC50 = 0.058 ug/ml 25695368
NPT90 Cell Line DU-145 Homo sapiens GI50 = 0.062 ug/ml 23398362
NPT33 Organism Japanese encephalitis virus Japanese encephalitis virus IC50 = 0.056 ug/ml 17118653
NPT2 Others Unspecified Activity = 28 % 23869482
NPT2 Others Unspecified Activity = 6 % 23869482
NPT191 Organism Hepatitis C virus Hepatitis C virus EC50 = 550 nM 22452568
NPT2 Others Unspecified CC50 = 7200 nM 21080629
NPT168 Cell Line P388 Mus musculus ED50 = 0.019 ug/ml 23558238
NPT1081 Cell Line BXPC-3 Homo sapiens GI50 = 0.07 ug/ml 23558238
NPT575 Cell Line KM-20L2 Homo sapiens GI50 = 0.15 ug/ml 16372404
NPT341 Organism Punta Toro virus Punta Toro virus IC50 = 0.042 ug/ml 11087618
NPT1081 Cell Line BXPC-3 Homo sapiens GI = 0.12 ug/ml 16180822
NPT4328 Organism Dengue virus type 4 Dengue virus 4 IC50 = 0.059 ug/ml 25856683
NPT397 Cell Line NCI-H460 Homo sapiens GI50 = 0.11 ug/ml 15165148
NPT2 Others Unspecified Inhibition = 83.1 % 9868159
NPT2 Others Unspecified FC = 0.06 25729554
NPT575 Cell Line KM-20L2 Homo sapiens GI50 = 0.084 ug/ml 18183025
NPT397 Cell Line NCI-H460 Homo sapiens GI50 = 0.053 ug/ml 18183025
NPT395 Cell Line SF-268 Homo sapiens GI50 = 0.12 ug/ml 18183025
NPT83 Cell Line MCF7 Homo sapiens GI50 = 0.046 ug/ml 18183025
NPT90 Cell Line DU-145 Homo sapiens GI50 = 0.051 ug/ml 18183025
NPT2 Others Unspecified Inhibition = 91.4 % 15217281
NPT2 Others Unspecified FC = 0.72 21868240
NPT83 Cell Line MCF7 Homo sapiens GI50 = 0.093 ug/ml 12398537
NPT168 Cell Line P388 Mus musculus ED50 < 0.01 ug/ml 22037378
NPT2 Others Unspecified Ratio CC50/EC50 = 12.72 19715320
NPT2 Others Unspecified GI50 = 0.047 ug/ml 22445674
NPT2 Others Unspecified ED50 = 0.02 ug/ml Open TG-GATES in vivo data: Hematology
NPT4329 Organism Rift Valley fever virus Rift Valley fever virus IC50 = 0.15 ug/ml 8229009
NPT4327 Organism Yellow fever virus Yellow fever virus IC50 = 0.053 ug/ml 24099364

  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 NPC69360 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
0.9481 High Similarity NPC54125
0.9481 High Similarity NPC89199
0.9423 High Similarity NPC182257
0.9359 High Similarity NPC304846
0.9241 High Similarity NPC474953
0.9006 High Similarity NPC110374
0.9006 High Similarity NPC289743
0.8896 High Similarity NPC115343
0.8896 High Similarity NPC1291
0.8851 High Similarity NPC77572
0.8848 High Similarity NPC474607
0.8795 High Similarity NPC474650
0.8675 High Similarity NPC475794
0.8333 Intermediate Similarity NPC4304
0.8314 Intermediate Similarity NPC475919
0.8314 Intermediate Similarity NPC474661
0.8303 Intermediate Similarity NPC190332
0.8303 Intermediate Similarity NPC181653
0.8224 Intermediate Similarity NPC254610
0.8204 Intermediate Similarity NPC474475
0.8193 Intermediate Similarity NPC100566
0.8155 Intermediate Similarity NPC470739
0.8155 Intermediate Similarity NPC225597
0.8155 Intermediate Similarity NPC477640
0.8144 Intermediate Similarity NPC475686
0.8144 Intermediate Similarity NPC58766
0.8133 Intermediate Similarity NPC476002
0.8121 Intermediate Similarity NPC320104
0.8084 Intermediate Similarity NPC252960
0.8059 Intermediate Similarity NPC187678
0.8036 Intermediate Similarity NPC290759
0.8036 Intermediate Similarity NPC266176
0.8036 Intermediate Similarity NPC82533
0.8036 Intermediate Similarity NPC158148
0.8024 Intermediate Similarity NPC198741
0.8012 Intermediate Similarity NPC218614
0.8012 Intermediate Similarity NPC237044
0.8 Intermediate Similarity NPC2314
0.8 Intermediate Similarity NPC474051
0.7988 Intermediate Similarity NPC311991
0.7965 Intermediate Similarity NPC474325
0.7953 Intermediate Similarity NPC304675
0.7919 Intermediate Similarity NPC474745
0.7892 Intermediate Similarity NPC205167
0.7892 Intermediate Similarity NPC97072
0.7892 Intermediate Similarity NPC249274
0.7892 Intermediate Similarity NPC215829
0.7886 Intermediate Similarity NPC474746
0.7886 Intermediate Similarity NPC475981
0.7861 Intermediate Similarity NPC15919
0.7857 Intermediate Similarity NPC180306
0.7849 Intermediate Similarity NPC49353
0.7838 Intermediate Similarity NPC475768
0.7831 Intermediate Similarity NPC59028
0.7831 Intermediate Similarity NPC92191
0.7816 Intermediate Similarity NPC244554
0.7803 Intermediate Similarity NPC474470
0.7751 Intermediate Similarity NPC247972
0.7733 Intermediate Similarity NPC57272
0.7727 Intermediate Similarity NPC248642
0.7697 Intermediate Similarity NPC230098
0.7688 Intermediate Similarity NPC228040
0.7684 Intermediate Similarity NPC156576
0.7679 Intermediate Similarity NPC165797
0.7661 Intermediate Similarity NPC298186
0.7661 Intermediate Similarity NPC301189
0.7661 Intermediate Similarity NPC474324
0.7661 Intermediate Similarity NPC57812
0.7657 Intermediate Similarity NPC118633
0.7657 Intermediate Similarity NPC148693
0.7657 Intermediate Similarity NPC294790
0.7647 Intermediate Similarity NPC470706
0.7643 Intermediate Similarity NPC312770
0.7643 Intermediate Similarity NPC14600
0.7643 Intermediate Similarity NPC204848
0.7643 Intermediate Similarity NPC160607
0.7643 Intermediate Similarity NPC41473
0.764 Intermediate Similarity NPC9867
0.763 Intermediate Similarity NPC231371
0.763 Intermediate Similarity NPC477115
0.7625 Intermediate Similarity NPC178466
0.7625 Intermediate Similarity NPC63628
0.7619 Intermediate Similarity NPC329837
0.7619 Intermediate Similarity NPC111485
0.7616 Intermediate Similarity NPC475845
0.7614 Intermediate Similarity NPC99179
0.7614 Intermediate Similarity NPC126284
0.7605 Intermediate Similarity NPC160931
0.7605 Intermediate Similarity NPC147091
0.7605 Intermediate Similarity NPC37205
0.7602 Intermediate Similarity NPC68328
0.76 Intermediate Similarity NPC283999
0.7595 Intermediate Similarity NPC299583
0.7582 Intermediate Similarity NPC469977
0.7572 Intermediate Similarity NPC75958
0.7572 Intermediate Similarity NPC474708
0.7561 Intermediate Similarity NPC77359
0.7557 Intermediate Similarity NPC114364
0.7557 Intermediate Similarity NPC320223
0.7546 Intermediate Similarity NPC16436
0.7545 Intermediate Similarity NPC78733
0.7544 Intermediate Similarity NPC232514
0.7544 Intermediate Similarity NPC276944
0.7544 Intermediate Similarity NPC238530
0.7543 Intermediate Similarity NPC128560
0.7543 Intermediate Similarity NPC229166
0.7543 Intermediate Similarity NPC199465
0.7541 Intermediate Similarity NPC33256
0.753 Intermediate Similarity NPC270811
0.753 Intermediate Similarity NPC148898
0.753 Intermediate Similarity NPC471073
0.7529 Intermediate Similarity NPC65403
0.7528 Intermediate Similarity NPC476575
0.7528 Intermediate Similarity NPC275132
0.7516 Intermediate Similarity NPC264956
0.7515 Intermediate Similarity NPC274026
0.75 Intermediate Similarity NPC471032
0.75 Intermediate Similarity NPC470935
0.75 Intermediate Similarity NPC475959
0.75 Intermediate Similarity NPC214116
0.7485 Intermediate Similarity NPC189782
0.7484 Intermediate Similarity NPC476570
0.747 Intermediate Similarity NPC474560
0.747 Intermediate Similarity NPC476568
0.7468 Intermediate Similarity NPC246974
0.7468 Intermediate Similarity NPC147247
0.7468 Intermediate Similarity NPC174191
0.7459 Intermediate Similarity NPC296742
0.7459 Intermediate Similarity NPC112676
0.7451 Intermediate Similarity NPC473960
0.7447 Intermediate Similarity NPC159101
0.7444 Intermediate Similarity NPC34780
0.7444 Intermediate Similarity NPC69213
0.7439 Intermediate Similarity NPC277857
0.7439 Intermediate Similarity NPC115144
0.7438 Intermediate Similarity NPC477837
0.7438 Intermediate Similarity NPC477838
0.743 Intermediate Similarity NPC233718
0.7425 Intermediate Similarity NPC82285
0.7425 Intermediate Similarity NPC223124
0.7425 Intermediate Similarity NPC18614
0.7425 Intermediate Similarity NPC133011
0.7423 Intermediate Similarity NPC313414
0.7423 Intermediate Similarity NPC5462
0.7421 Intermediate Similarity NPC474595
0.7414 Intermediate Similarity NPC66573
0.7414 Intermediate Similarity NPC160570
0.7403 Intermediate Similarity NPC157740
0.7403 Intermediate Similarity NPC99798
0.7403 Intermediate Similarity NPC191302
0.7403 Intermediate Similarity NPC224293
0.7399 Intermediate Similarity NPC124657
0.7394 Intermediate Similarity NPC59907
0.7394 Intermediate Similarity NPC37144
0.7391 Intermediate Similarity NPC29472
0.7391 Intermediate Similarity NPC275150
0.7389 Intermediate Similarity NPC104077
0.7389 Intermediate Similarity NPC219671
0.7389 Intermediate Similarity NPC259742
0.7389 Intermediate Similarity NPC97316
0.7389 Intermediate Similarity NPC135772
0.7389 Intermediate Similarity NPC147616
0.7389 Intermediate Similarity NPC106739
0.7389 Intermediate Similarity NPC471505
0.7381 Intermediate Similarity NPC10875
0.7381 Intermediate Similarity NPC10730
0.7375 Intermediate Similarity NPC474039
0.7374 Intermediate Similarity NPC476574
0.7374 Intermediate Similarity NPC312918
0.7374 Intermediate Similarity NPC477561
0.7374 Intermediate Similarity NPC155442
0.7372 Intermediate Similarity NPC329595
0.7372 Intermediate Similarity NPC326599
0.7365 Intermediate Similarity NPC127402
0.7365 Intermediate Similarity NPC52475
0.7358 Intermediate Similarity NPC7018
0.7358 Intermediate Similarity NPC101624
0.7358 Intermediate Similarity NPC18576
0.7358 Intermediate Similarity NPC184938
0.7356 Intermediate Similarity NPC150879
0.7356 Intermediate Similarity NPC247389
0.7353 Intermediate Similarity NPC78359
0.7353 Intermediate Similarity NPC40389
0.7353 Intermediate Similarity NPC148014
0.7353 Intermediate Similarity NPC315707
0.7353 Intermediate Similarity NPC65490
0.7349 Intermediate Similarity NPC182119
0.7346 Intermediate Similarity NPC472711
0.7345 Intermediate Similarity NPC477558
0.7342 Intermediate Similarity NPC218530
0.7342 Intermediate Similarity NPC58585
0.7341 Intermediate Similarity NPC167546
0.7341 Intermediate Similarity NPC16805
0.7341 Intermediate Similarity NPC302527
0.7338 Intermediate Similarity NPC251466
0.7338 Intermediate Similarity NPC156944
0.7337 Intermediate Similarity NPC117717
0.7337 Intermediate Similarity NPC138487
0.7337 Intermediate Similarity NPC94499
0.7337 Intermediate Similarity NPC216459

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC69360 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
0.8354 Intermediate Similarity NPD4005 Discontinued
0.7711 Intermediate Similarity NPD2978 Approved
0.7711 Intermediate Similarity NPD2977 Approved
0.7711 Intermediate Similarity NPD5773 Approved
0.7711 Intermediate Similarity NPD5772 Approved
0.7701 Intermediate Similarity NPD7007 Discovery
0.7679 Intermediate Similarity NPD7975 Clinical (unspecified phase)
0.7658 Intermediate Similarity NPD1375 Discontinued
0.7625 Intermediate Similarity NPD6658 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD52 Approved
0.75 Intermediate Similarity NPD7526 Approved
0.75 Intermediate Similarity NPD7527 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD7243 Clinical (unspecified phase)
0.7457 Intermediate Similarity NPD2970 Approved
0.7457 Intermediate Similarity NPD2969 Approved
0.7439 Intermediate Similarity NPD4123 Phase 3
0.7407 Intermediate Similarity NPD6331 Phase 2
0.7368 Intermediate Similarity NPD5604 Discontinued
0.7362 Intermediate Similarity NPD5241 Discontinued
0.7353 Intermediate Similarity NPD2560 Approved
0.7353 Intermediate Similarity NPD2563 Approved
0.7346 Intermediate Similarity NPD4237 Approved
0.7346 Intermediate Similarity NPD4236 Phase 3
0.7325 Intermediate Similarity NPD2674 Phase 3
0.7321 Intermediate Similarity NPD4675 Approved
0.7321 Intermediate Similarity NPD4678 Approved
0.7314 Intermediate Similarity NPD27 Approved
0.7314 Intermediate Similarity NPD2489 Approved
0.7308 Intermediate Similarity NPD6843 Phase 3
0.7308 Intermediate Similarity NPD6842 Approved
0.7308 Intermediate Similarity NPD6841 Approved
0.7299 Intermediate Similarity NPD3051 Approved
0.7267 Intermediate Similarity NPD2161 Phase 2
0.7253 Intermediate Similarity NPD4663 Approved
0.7237 Intermediate Similarity NPD3705 Approved
0.7229 Intermediate Similarity NPD4739 Approved
0.7215 Intermediate Similarity NPD554 Clinical (unspecified phase)
0.7213 Intermediate Similarity NPD7906 Approved
0.72 Intermediate Similarity NPD6071 Discontinued
0.7182 Intermediate Similarity NPD7313 Approved
0.7182 Intermediate Similarity NPD4578 Approved
0.7182 Intermediate Similarity NPD4577 Approved
0.7182 Intermediate Similarity NPD7312 Approved
0.7182 Intermediate Similarity NPD7311 Approved
0.7182 Intermediate Similarity NPD7310 Approved
0.7176 Intermediate Similarity NPD4773 Phase 2
0.7176 Intermediate Similarity NPD4772 Phase 2
0.7168 Intermediate Similarity NPD4055 Discovery
0.7152 Intermediate Similarity NPD3145 Approved
0.7152 Intermediate Similarity NPD3144 Approved
0.7143 Intermediate Similarity NPD7237 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD7309 Approved
0.7143 Intermediate Similarity NPD2122 Discontinued
0.7108 Intermediate Similarity NPD6783 Clinical (unspecified phase)
0.7099 Intermediate Similarity NPD4108 Discontinued
0.7097 Intermediate Similarity NPD7296 Approved
0.7093 Intermediate Similarity NPD6818 Clinical (unspecified phase)
0.7083 Intermediate Similarity NPD5261 Clinical (unspecified phase)
0.7076 Intermediate Similarity NPD5089 Approved
0.7076 Intermediate Similarity NPD5090 Approved
0.7073 Intermediate Similarity NPD4664 Clinical (unspecified phase)
0.7056 Intermediate Similarity NPD7827 Phase 1
0.7048 Intermediate Similarity NPD5084 Clinical (unspecified phase)
0.7048 Intermediate Similarity NPD3692 Discontinued
0.703 Intermediate Similarity NPD3060 Approved
0.7022 Intermediate Similarity NPD4481 Phase 3
0.7012 Intermediate Similarity NPD2029 Clinical (unspecified phase)
0.6994 Remote Similarity NPD5563 Clinical (unspecified phase)
0.6989 Remote Similarity NPD7201 Clinical (unspecified phase)
0.6981 Remote Similarity NPD2669 Clinical (unspecified phase)
0.697 Remote Similarity NPD7153 Discontinued
0.6957 Remote Similarity NPD2238 Phase 2
0.6936 Remote Similarity NPD37 Approved
0.6936 Remote Similarity NPD7945 Clinical (unspecified phase)
0.6928 Remote Similarity NPD1357 Approved
0.6923 Remote Similarity NPD1754 Clinical (unspecified phase)
0.6923 Remote Similarity NPD4584 Approved
0.6923 Remote Similarity NPD9622 Approved
0.6901 Remote Similarity NPD3686 Approved
0.6901 Remote Similarity NPD3687 Approved
0.6897 Remote Similarity NPD7089 Clinical (unspecified phase)
0.6894 Remote Similarity NPD839 Approved
0.6894 Remote Similarity NPD840 Approved
0.6889 Remote Similarity NPD5602 Clinical (unspecified phase)
0.6875 Remote Similarity NPD3027 Phase 3
0.6871 Remote Similarity NPD1772 Clinical (unspecified phase)
0.6865 Remote Similarity NPD7090 Clinical (unspecified phase)
0.6845 Remote Similarity NPD5307 Clinical (unspecified phase)
0.6845 Remote Similarity NPD2677 Approved
0.6845 Remote Similarity NPD2219 Phase 1
0.6826 Remote Similarity NPD6674 Discontinued
0.6826 Remote Similarity NPD5177 Phase 3
0.6826 Remote Similarity NPD4162 Approved
0.6823 Remote Similarity NPD4420 Approved
0.6818 Remote Similarity NPD4966 Approved
0.6818 Remote Similarity NPD4967 Phase 2
0.6818 Remote Similarity NPD4965 Approved
0.6815 Remote Similarity NPD1669 Approved
0.6815 Remote Similarity NPD3676 Clinical (unspecified phase)
0.6813 Remote Similarity NPD600 Approved
0.6813 Remote Similarity NPD596 Approved
0.6809 Remote Similarity NPD3408 Clinical (unspecified phase)
0.6806 Remote Similarity NPD5582 Discontinued
0.6804 Remote Similarity NPD3450 Approved
0.6804 Remote Similarity NPD3452 Approved
0.6802 Remote Similarity NPD4210 Discontinued
0.679 Remote Similarity NPD1726 Clinical (unspecified phase)
0.6774 Remote Similarity NPD9381 Approved
0.6774 Remote Similarity NPD8053 Approved
0.6774 Remote Similarity NPD8054 Approved
0.6774 Remote Similarity NPD9384 Approved
0.6769 Remote Similarity NPD5006 Approved
0.6769 Remote Similarity NPD5005 Approved
0.6768 Remote Similarity NPD823 Approved
0.6768 Remote Similarity NPD817 Approved
0.6765 Remote Similarity NPD4357 Discontinued
0.6761 Remote Similarity NPD2358 Clinical (unspecified phase)
0.676 Remote Similarity NPD6107 Approved
0.675 Remote Similarity NPD1712 Approved
0.6748 Remote Similarity NPD1613 Approved
0.6748 Remote Similarity NPD1558 Phase 1
0.6748 Remote Similarity NPD1612 Clinical (unspecified phase)
0.6742 Remote Similarity NPD6234 Discontinued
0.674 Remote Similarity NPD2898 Approved
0.6739 Remote Similarity NPD6996 Clinical (unspecified phase)
0.6728 Remote Similarity NPD5109 Approved
0.6728 Remote Similarity NPD5110 Phase 2
0.6728 Remote Similarity NPD5111 Phase 2
0.6725 Remote Similarity NPD681 Clinical (unspecified phase)
0.6725 Remote Similarity NPD4160 Clinical (unspecified phase)
0.6722 Remote Similarity NPD7315 Approved
0.6722 Remote Similarity NPD4010 Discontinued
0.6718 Remote Similarity NPD2493 Approved
0.6718 Remote Similarity NPD2494 Approved
0.6688 Remote Similarity NPD776 Approved
0.6687 Remote Similarity NPD1130 Approved
0.6687 Remote Similarity NPD558 Phase 2
0.6687 Remote Similarity NPD1132 Approved
0.6687 Remote Similarity NPD1136 Approved
0.6686 Remote Similarity NPD6072 Discontinued
0.6684 Remote Similarity NPD2974 Approved
0.6684 Remote Similarity NPD2975 Approved
0.6684 Remote Similarity NPD2973 Approved
0.6667 Remote Similarity NPD2157 Approved
0.6667 Remote Similarity NPD7493 Clinical (unspecified phase)
0.6667 Remote Similarity NPD1774 Approved
0.665 Remote Similarity NPD4004 Approved
0.665 Remote Similarity NPD4002 Approved
0.6647 Remote Similarity NPD9570 Approved
0.6647 Remote Similarity NPD3640 Phase 3
0.6647 Remote Similarity NPD3641 Approved
0.6647 Remote Similarity NPD3639 Approved
0.6646 Remote Similarity NPD3620 Phase 2
0.6646 Remote Similarity NPD3619 Clinical (unspecified phase)
0.6631 Remote Similarity NPD7281 Phase 3
0.6631 Remote Similarity NPD7280 Phase 3
0.663 Remote Similarity NPD8156 Discontinued
0.663 Remote Similarity NPD4606 Clinical (unspecified phase)
0.6626 Remote Similarity NPD601 Approved
0.6626 Remote Similarity NPD597 Approved
0.6626 Remote Similarity NPD598 Approved
0.6616 Remote Similarity NPD4582 Approved
0.6616 Remote Similarity NPD4583 Approved
0.6614 Remote Similarity NPD3857 Clinical (unspecified phase)
0.6611 Remote Similarity NPD4666 Phase 3
0.6611 Remote Similarity NPD6746 Phase 2
0.6609 Remote Similarity NPD1653 Approved
0.6604 Remote Similarity NPD3685 Discontinued
0.6597 Remote Similarity NPD2488 Approved
0.6597 Remote Similarity NPD2490 Approved
0.6593 Remote Similarity NPD4083 Discontinued
0.6592 Remote Similarity NPD7833 Phase 2
0.6592 Remote Similarity NPD7831 Phase 2
0.6592 Remote Similarity NPD7832 Clinical (unspecified phase)
0.6591 Remote Similarity NPD3778 Approved
0.659 Remote Similarity NPD1349 Approved
0.659 Remote Similarity NPD1351 Approved
0.659 Remote Similarity NPD1350 Approved
0.6587 Remote Similarity NPD1753 Discontinued
0.6584 Remote Similarity NPD9621 Approved
0.6584 Remote Similarity NPD9620 Approved
0.6584 Remote Similarity NPD9619 Approved
0.6582 Remote Similarity NPD4580 Approved
0.6582 Remote Similarity NPD1091 Approved
0.658 Remote Similarity NPD3473 Clinical (unspecified phase)
0.6579 Remote Similarity NPD3349 Phase 2
0.6579 Remote Similarity NPD4157 Discontinued
0.6576 Remote Similarity NPD8251 Approved
0.6576 Remote Similarity NPD3909 Discontinued
0.6576 Remote Similarity NPD8252 Approved
0.6576 Remote Similarity NPD7228 Approved
0.6576 Remote Similarity NPD8099 Discontinued
0.6571 Remote Similarity NPD4017 Approved
0.6566 Remote Similarity NPD2492 Phase 1
0.6564 Remote Similarity NPD1024 Discontinued
0.6562 Remote Similarity NPD3634 Approved
0.6562 Remote Similarity NPD3633 Approved
0.6562 Remote Similarity NPD2922 Phase 1
0.6556 Remote Similarity NPD5709 Phase 3
0.6554 Remote Similarity NPD3383 Approved

Structure

External Identifiers

PubChem CID   73065
ChEMBL   CHEMBL487798
ZINC  

Physicochemical Properties

Molecular Weight:  291.07
ALogP:  -1.8067
MLogP:  2.23
XLogP:  -0.389
# Rotatable Bonds:  4
Polar Surface Area:  111.74
# H-Bond Aceptor:  5
# H-Bond Donor:  4
# Rings:  4
# Heavy Atoms:  21

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