Natural Product: NPC90723

Natural Product ID:  NPC90723
Common Name:   Pericalline
IUPAC Name:  
Synonyms:   Pericalline
Molecular Formula:   C18H20N2
Standard InCHIKey:  YBWKMVPRGFJPHD-LELDJUSMSA-N
Standard InCHI:  InChI=1S/C18H20N2/c1-3-13-10-20-7-5-16(13)12(2)17-9-18-14(4-6-19-18)8-15(17)11-20/h3-4,6,8-9,16,19H,2,5,7,10-11H2,1H3/b13-3-/t16-/m0/s1
Canonical SMILES:  C/C=C1/CN2CC[C@H]1C(=C)c1c(C2)cc2c(c1)[nH]cc2
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
NPO12320 Adonis amurensis Species Ranunculaceae Eukaryota HerDing*
NPO26820 Aspidosperma dasycarpon Species Apocynaceae Eukaryota HerDing*
NPO30717 Metaplexis japonica Species Apocynaceae Eukaryota HerDing*
NPO5881 Catharanthus roseus Species Apocynaceae Eukaryota HerDing*
NPO26820 Aspidosperma dasycarpon Species Apocynaceae Eukaryota TCMID*
NPO4657 Cynanchum rostellatum Species Apocynaceae Eukaryota TCMID*
NPO12320 Adonis amurensis Species Ranunculaceae Eukaryota TCMID*
NPO5881 Catharanthus roseus Species Apocynaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT26 Individual Protein Reverse transcriptase Human immunodeficiency virus 1 IC50 > 200 ug/ml 1710653

  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 NPC90723 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
0.9408 High Similarity NPC56765
0.9221 High Similarity NPC44773
0.9221 High Similarity NPC215584
0.9156 High Similarity NPC318065
0.9156 High Similarity NPC206819
0.8968 High Similarity NPC286427
0.891 High Similarity NPC41257
0.8792 High Similarity NPC73767
0.8766 High Similarity NPC33421
0.8733 High Similarity NPC59084
0.8733 High Similarity NPC469779
0.8733 High Similarity NPC469761
0.8733 High Similarity NPC469768
0.8733 High Similarity NPC469783
0.8733 High Similarity NPC469767
0.8733 High Similarity NPC469780
0.8733 High Similarity NPC469784
0.8675 High Similarity NPC469766
0.8667 High Similarity NPC110126
0.8658 High Similarity NPC84911
0.8642 High Similarity NPC194411
0.8591 High Similarity NPC96102
0.8591 High Similarity NPC29886
0.8591 High Similarity NPC261195
0.8533 High Similarity NPC105127
0.8526 High Similarity NPC53947
0.8485 Intermediate Similarity NPC37423
0.8485 Intermediate Similarity NPC275305
0.8471 Intermediate Similarity NPC470233
0.8462 Intermediate Similarity NPC321911
0.8443 Intermediate Similarity NPC176199
0.8443 Intermediate Similarity NPC215795
0.8397 Intermediate Similarity NPC179787
0.8397 Intermediate Similarity NPC469811
0.8397 Intermediate Similarity NPC201380
0.8387 Intermediate Similarity NPC314372
0.8383 Intermediate Similarity NPC68354
0.8377 Intermediate Similarity NPC190296
0.8366 Intermediate Similarity NPC279081
0.8355 Intermediate Similarity NPC169433
0.8333 Intermediate Similarity NPC63545
0.8333 Intermediate Similarity NPC288838
0.8322 Intermediate Similarity NPC82295
0.8313 Intermediate Similarity NPC51054
0.8312 Intermediate Similarity NPC63157
0.8312 Intermediate Similarity NPC473868
0.8302 Intermediate Similarity NPC325903
0.8291 Intermediate Similarity NPC105818
0.8291 Intermediate Similarity NPC24678
0.8289 Intermediate Similarity NPC251722
0.8289 Intermediate Similarity NPC314102
0.828 Intermediate Similarity NPC21605
0.8278 Intermediate Similarity NPC198988
0.8255 Intermediate Similarity NPC282398
0.8247 Intermediate Similarity NPC2949
0.8247 Intermediate Similarity NPC230002
0.8224 Intermediate Similarity NPC325252
0.8218 Intermediate Similarity NPC95783
0.8217 Intermediate Similarity NPC143872
0.8187 Intermediate Similarity NPC469765
0.8187 Intermediate Similarity NPC469786
0.8187 Intermediate Similarity NPC469763
0.8187 Intermediate Similarity NPC25008
0.8187 Intermediate Similarity NPC259644
0.8187 Intermediate Similarity NPC469760
0.8187 Intermediate Similarity NPC200214
0.8187 Intermediate Similarity NPC73952
0.8182 Intermediate Similarity NPC312092
0.8165 Intermediate Similarity NPC471957
0.8153 Intermediate Similarity NPC159856
0.8148 Intermediate Similarity NPC216643
0.8137 Intermediate Similarity NPC70922
0.8137 Intermediate Similarity NPC75540
0.8137 Intermediate Similarity NPC80597
0.8137 Intermediate Similarity NPC212376
0.8137 Intermediate Similarity NPC211572
0.811 Intermediate Similarity NPC470203
0.8079 Intermediate Similarity NPC475450
0.8079 Intermediate Similarity NPC179365
0.8065 Intermediate Similarity NPC88097
0.8052 Intermediate Similarity NPC150259
0.805 Intermediate Similarity NPC477134
0.8049 Intermediate Similarity NPC470204
0.8037 Intermediate Similarity NPC236711
0.8025 Intermediate Similarity NPC34844
0.8024 Intermediate Similarity NPC201700
0.8013 Intermediate Similarity NPC22079
0.8013 Intermediate Similarity NPC475428
0.8012 Intermediate Similarity NPC470823
0.7988 Intermediate Similarity NPC135141
0.7988 Intermediate Similarity NPC92796
0.7975 Intermediate Similarity NPC469785
0.7964 Intermediate Similarity NPC49954
0.7964 Intermediate Similarity NPC474561
0.7963 Intermediate Similarity NPC141926
0.7952 Intermediate Similarity NPC317105
0.7947 Intermediate Similarity NPC473587
0.7939 Intermediate Similarity NPC122141
0.7927 Intermediate Similarity NPC469762
0.7901 Intermediate Similarity NPC216713
0.7898 Intermediate Similarity NPC115611
0.7895 Intermediate Similarity NPC280852
0.7895 Intermediate Similarity NPC474958
0.7881 Intermediate Similarity NPC473762
0.7871 Intermediate Similarity NPC218268
0.7866 Intermediate Similarity NPC184476
0.7857 Intermediate Similarity NPC160105
0.7849 Intermediate Similarity NPC151939
0.7845 Intermediate Similarity NPC229332
0.7844 Intermediate Similarity NPC472587
0.7844 Intermediate Similarity NPC311276
0.7844 Intermediate Similarity NPC194640
0.784 Intermediate Similarity NPC40070
0.7826 Intermediate Similarity NPC470111
0.7824 Intermediate Similarity NPC82331
0.7824 Intermediate Similarity NPC201634
0.7812 Intermediate Similarity NPC204141
0.7812 Intermediate Similarity NPC470440
0.7792 Intermediate Similarity NPC473930
0.7785 Intermediate Similarity NPC46358
0.7784 Intermediate Similarity NPC282231
0.7778 Intermediate Similarity NPC313791
0.7771 Intermediate Similarity NPC474880
0.7771 Intermediate Similarity NPC221786
0.7771 Intermediate Similarity NPC475990
0.7759 Intermediate Similarity NPC300688
0.7748 Intermediate Similarity NPC250361
0.7738 Intermediate Similarity NPC40779
0.7725 Intermediate Similarity NPC279918
0.7718 Intermediate Similarity NPC41174
0.7707 Intermediate Similarity NPC125746
0.7706 Intermediate Similarity NPC63751
0.7701 Intermediate Similarity NPC213468
0.7697 Intermediate Similarity NPC38736
0.7692 Intermediate Similarity NPC274229
0.7674 Intermediate Similarity NPC314603
0.7674 Intermediate Similarity NPC477611
0.767 Intermediate Similarity NPC19679
0.7669 Intermediate Similarity NPC124005
0.7665 Intermediate Similarity NPC6436
0.7661 Intermediate Similarity NPC280548
0.7654 Intermediate Similarity NPC316069
0.7651 Intermediate Similarity NPC476464
0.7647 Intermediate Similarity NPC49217
0.764 Intermediate Similarity NPC474707
0.7633 Intermediate Similarity NPC149265
0.763 Intermediate Similarity NPC293216
0.7624 Intermediate Similarity NPC316359
0.7624 Intermediate Similarity NPC315617
0.7619 Intermediate Similarity NPC131718
0.7619 Intermediate Similarity NPC229173
0.7616 Intermediate Similarity NPC27740
0.761 Intermediate Similarity NPC104483
0.7598 Intermediate Similarity NPC317030
0.7598 Intermediate Similarity NPC204565
0.759 Intermediate Similarity NPC476297
0.759 Intermediate Similarity NPC476219
0.7588 Intermediate Similarity NPC17751
0.7588 Intermediate Similarity NPC280864
0.7584 Intermediate Similarity NPC215519
0.7578 Intermediate Similarity NPC20144
0.7561 Intermediate Similarity NPC2272
0.756 Intermediate Similarity NPC230869
0.7558 Intermediate Similarity NPC97343
0.7557 Intermediate Similarity NPC314919
0.7556 Intermediate Similarity NPC173028
0.7556 Intermediate Similarity NPC65215
0.7544 Intermediate Similarity NPC54988
0.7543 Intermediate Similarity NPC248454
0.7529 Intermediate Similarity NPC271797
0.7529 Intermediate Similarity NPC21174
0.7529 Intermediate Similarity NPC162799
0.7528 Intermediate Similarity NPC228835
0.7527 Intermediate Similarity NPC314058
0.7527 Intermediate Similarity NPC316018
0.7514 Intermediate Similarity NPC233936
0.7514 Intermediate Similarity NPC307191
0.7514 Intermediate Similarity NPC470498
0.75 Intermediate Similarity NPC193740
0.75 Intermediate Similarity NPC11126
0.75 Intermediate Similarity NPC32002
0.75 Intermediate Similarity NPC167635
0.75 Intermediate Similarity NPC316811
0.75 Intermediate Similarity NPC315348
0.75 Intermediate Similarity NPC129721
0.75 Intermediate Similarity NPC122718
0.7471 Intermediate Similarity NPC225018
0.7471 Intermediate Similarity NPC16667
0.7458 Intermediate Similarity NPC16659
0.7455 Intermediate Similarity NPC187951
0.7455 Intermediate Similarity NPC37548
0.7451 Intermediate Similarity NPC166424
0.7451 Intermediate Similarity NPC245244
0.7451 Intermediate Similarity NPC146373
0.745 Intermediate Similarity NPC143603
0.745 Intermediate Similarity NPC91958
0.7444 Intermediate Similarity NPC94752
0.7443 Intermediate Similarity NPC14113
0.7443 Intermediate Similarity NPC145885
0.7443 Intermediate Similarity NPC59269

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC90723 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
0.9226 High Similarity NPD3323 Discontinued
0.9073 High Similarity NPD3100 Discontinued
0.8938 High Similarity NPD3610 Approved
0.8938 High Similarity NPD3609 Approved
0.8926 High Similarity NPD1722 Approved
0.8808 High Similarity NPD5254 Discontinued
0.8766 High Similarity NPD2172 Phase 1
0.872 High Similarity NPD4181 Approved
0.8696 High Similarity NPD2640 Approved
0.8696 High Similarity NPD2641 Approved
0.8667 High Similarity NPD786 Approved
0.8591 High Similarity NPD198 Clinical (unspecified phase)
0.858 High Similarity NPD4779 Clinical (unspecified phase)
0.8434 Intermediate Similarity NPD4075 Phase 2
0.8418 Intermediate Similarity NPD2837 Discontinued
0.8397 Intermediate Similarity NPD4547 Phase 3
0.8385 Intermediate Similarity NPD1403 Approved
0.8385 Intermediate Similarity NPD1404 Approved
0.8383 Intermediate Similarity NPD3506 Approved
0.8383 Intermediate Similarity NPD3505 Approved
0.8373 Intermediate Similarity NPD4128 Approved
0.8344 Intermediate Similarity NPD4374 Clinical (unspecified phase)
0.8333 Intermediate Similarity NPD1853 Clinical (unspecified phase)
0.8333 Intermediate Similarity NPD4079 Approved
0.8333 Intermediate Similarity NPD1683 Approved
0.8333 Intermediate Similarity NPD4076 Approved
0.8333 Intermediate Similarity NPD5315 Discontinued
0.8324 Intermediate Similarity NPD5145 Clinical (unspecified phase)
0.8314 Intermediate Similarity NPD3486 Clinical (unspecified phase)
0.8293 Intermediate Similarity NPD2642 Approved
0.8293 Intermediate Similarity NPD2639 Approved
0.8255 Intermediate Similarity NPD3475 Approved
0.8255 Intermediate Similarity NPD3476 Approved
0.8247 Intermediate Similarity NPD3943 Clinical (unspecified phase)
0.8246 Intermediate Similarity NPD3607 Clinical (unspecified phase)
0.8242 Intermediate Similarity NPD2185 Clinical (unspecified phase)
0.8232 Intermediate Similarity NPD5744 Clinical (unspecified phase)
0.8199 Intermediate Similarity NPD2580 Discontinued
0.8092 Intermediate Similarity NPD4029 Approved
0.8092 Intermediate Similarity NPD4030 Approved
0.8092 Intermediate Similarity NPD4028 Approved
0.8054 Intermediate Similarity NPD2118 Approved
0.8054 Intermediate Similarity NPD2119 Approved
0.8025 Intermediate Similarity NPD977 Approved
0.8025 Intermediate Similarity NPD976 Approved
0.8025 Intermediate Similarity NPD975 Approved
0.8025 Intermediate Similarity NPD4637 Clinical (unspecified phase)
0.8024 Intermediate Similarity NPD5069 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD3961 Discontinued
0.7989 Intermediate Similarity NPD6610 Clinical (unspecified phase)
0.7989 Intermediate Similarity NPD2960 Clinical (unspecified phase)
0.7988 Intermediate Similarity NPD4112 Clinical (unspecified phase)
0.7965 Intermediate Similarity NPD6277 Clinical (unspecified phase)
0.7953 Intermediate Similarity NPD2144 Approved
0.7953 Intermediate Similarity NPD6203 Clinical (unspecified phase)
0.7944 Intermediate Similarity NPD6664 Approved
0.7919 Intermediate Similarity NPD3038 Discontinued
0.7895 Intermediate Similarity NPD6375 Clinical (unspecified phase)
0.7874 Intermediate Similarity NPD5106 Approved
0.7874 Intermediate Similarity NPD5105 Approved
0.787 Intermediate Similarity NPD5436 Phase 1
0.7862 Intermediate Similarity NPD1918 Clinical (unspecified phase)
0.7857 Intermediate Similarity NPD3385 Approved
0.7857 Intermediate Similarity NPD3944 Approved
0.7857 Intermediate Similarity NPD3942 Approved
0.7841 Intermediate Similarity NPD4426 Clinical (unspecified phase)
0.784 Intermediate Similarity NPD4463 Approved
0.784 Intermediate Similarity NPD4462 Approved
0.7836 Intermediate Similarity NPD5065 Approved
0.7829 Intermediate Similarity NPD3654 Approved
0.7821 Intermediate Similarity NPD1262 Discovery
0.7815 Intermediate Similarity NPD992 Clinical (unspecified phase)
0.7815 Intermediate Similarity NPD991 Phase 2
0.7811 Intermediate Similarity NPD4640 Approved
0.7811 Intermediate Similarity NPD4638 Approved
0.7811 Intermediate Similarity NPD4639 Approved
0.7811 Intermediate Similarity NPD5021 Discontinued
0.7799 Intermediate Similarity NPD2007 Clinical (unspecified phase)
0.7799 Intermediate Similarity NPD2006 Phase 2
0.7797 Intermediate Similarity NPD8431 Approved
0.7778 Intermediate Similarity NPD2430 Phase 2
0.7765 Intermediate Similarity NPD4184 Clinical (unspecified phase)
0.7758 Intermediate Similarity NPD2150 Discontinued
0.7714 Intermediate Similarity NPD1707 Approved
0.7714 Intermediate Similarity NPD1708 Approved
0.7711 Intermediate Similarity NPD2865 Clinical (unspecified phase)
0.7697 Intermediate Similarity NPD2165 Phase 1
0.7651 Intermediate Similarity NPD2748 Clinical (unspecified phase)
0.7651 Intermediate Similarity NPD3114 Approved
0.7651 Intermediate Similarity NPD3115 Approved
0.7651 Intermediate Similarity NPD3113 Approved
0.7651 Intermediate Similarity NPD3112 Approved
0.7633 Intermediate Similarity NPD3583 Phase 2
0.7614 Intermediate Similarity NPD1895 Discontinued
0.7602 Intermediate Similarity NPD2390 Clinical (unspecified phase)
0.7598 Intermediate Similarity NPD2310 Clinical (unspecified phase)
0.7595 Intermediate Similarity NPD6554 Approved
0.7595 Intermediate Similarity NPD45 Approved
0.7571 Intermediate Similarity NPD5728 Clinical (unspecified phase)
0.7543 Intermediate Similarity NPD7111 Discontinued
0.7532 Intermediate Similarity NPD1256 Approved
0.7532 Intermediate Similarity NPD1253 Approved
0.7532 Intermediate Similarity NPD1254 Approved
0.7532 Intermediate Similarity NPD1255 Approved
0.7514 Intermediate Similarity NPD5934 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD2070 Approved
0.75 Intermediate Similarity NPD2075 Approved
0.75 Intermediate Similarity NPD2072 Approved
0.75 Intermediate Similarity NPD2071 Approved
0.75 Intermediate Similarity NPD2069 Approved
0.75 Intermediate Similarity NPD2073 Approved
0.75 Intermediate Similarity NPD2074 Approved
0.75 Intermediate Similarity NPD1192 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD2068 Approved
0.75 Intermediate Similarity NPD5590 Clinical (unspecified phase)
0.7472 Intermediate Similarity NPD1332 Clinical (unspecified phase)
0.7471 Intermediate Similarity NPD2385 Clinical (unspecified phase)
0.7458 Intermediate Similarity NPD6595 Phase 3
0.7457 Intermediate Similarity NPD1326 Approved
0.7457 Intermediate Similarity NPD1325 Approved
0.7444 Intermediate Similarity NPD6217 Discontinued
0.7429 Intermediate Similarity NPD3799 Suspended
0.7425 Intermediate Similarity NPD3339 Approved
0.7418 Intermediate Similarity NPD6281 Approved
0.7417 Intermediate Similarity NPD271 Approved
0.7417 Intermediate Similarity NPD270 Clinical (unspecified phase)
0.7417 Intermediate Similarity NPD268 Approved
0.7403 Intermediate Similarity NPD9583 Approved
0.7391 Intermediate Similarity NPD768 Clinical (unspecified phase)
0.7377 Intermediate Similarity NPD6630 Clinical (unspecified phase)
0.7358 Intermediate Similarity NPD4880 Discontinued
0.7351 Intermediate Similarity NPD7024 Clinical (unspecified phase)
0.7337 Intermediate Similarity NPD473 Clinical (unspecified phase)
0.7337 Intermediate Similarity NPD3404 Approved
0.7325 Intermediate Similarity NPD715 Phase 3
0.7318 Intermediate Similarity NPD4649 Clinical (unspecified phase)
0.7314 Intermediate Similarity NPD6827 Clinical (unspecified phase)
0.7314 Intermediate Similarity NPD6828 Phase 2
0.7312 Intermediate Similarity NPD6278 Clinical (unspecified phase)
0.7306 Intermediate Similarity NPD2125 Clinical (unspecified phase)
0.7303 Intermediate Similarity NPD40 Phase 2
0.7303 Intermediate Similarity NPD5730 Phase 2
0.7289 Intermediate Similarity NPD4703 Approved
0.7289 Intermediate Similarity NPD4702 Approved
0.7288 Intermediate Similarity NPD749 Clinical (unspecified phase)
0.7283 Intermediate Similarity NPD6180 Clinical (unspecified phase)
0.7283 Intermediate Similarity NPD2720 Phase 1
0.7283 Intermediate Similarity NPD2719 Clinical (unspecified phase)
0.7278 Intermediate Similarity NPD3318 Approved
0.7278 Intermediate Similarity NPD3319 Phase 1
0.7278 Intermediate Similarity NPD803 Phase 1
0.7278 Intermediate Similarity NPD3320 Approved
0.7273 Intermediate Similarity NPD9357 Approved
0.7268 Intermediate Similarity NPD8110 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD9392 Approved
0.7267 Intermediate Similarity NPD9396 Approved
0.7261 Intermediate Similarity NPD947 Approved
0.7258 Intermediate Similarity NPD7619 Phase 3
0.7258 Intermediate Similarity NPD7618 Phase 3
0.7248 Intermediate Similarity NPD269 Clinical (unspecified phase)
0.7241 Intermediate Similarity NPD1248 Discontinued
0.7238 Intermediate Similarity NPD7564 Discontinued
0.7238 Intermediate Similarity NPD4957 Phase 2
0.7232 Intermediate Similarity NPD482 Approved
0.7222 Intermediate Similarity NPD7185 Discontinued
0.7219 Intermediate Similarity NPD2012 Clinical (unspecified phase)
0.7216 Intermediate Similarity NPD3117 Approved
0.7216 Intermediate Similarity NPD3116 Approved
0.7207 Intermediate Similarity NPD1327 Discontinued
0.7198 Intermediate Similarity NPD4298 Clinical (unspecified phase)
0.7184 Intermediate Similarity NPD4550 Clinical (unspecified phase)
0.7182 Intermediate Similarity NPD2092 Phase 2
0.7182 Intermediate Similarity NPD2094 Phase 2
0.7182 Intermediate Similarity NPD2095 Phase 2
0.717 Intermediate Similarity NPD1251 Discontinued
0.7167 Intermediate Similarity NPD5473 Discontinued
0.7158 Intermediate Similarity NPD5820 Clinical (unspecified phase)
0.7158 Intermediate Similarity NPD2793 Discontinued
0.7151 Intermediate Similarity NPD4615 Phase 2
0.7143 Intermediate Similarity NPD2096 Phase 2
0.7143 Intermediate Similarity NPD2091 Phase 2
0.7134 Intermediate Similarity NPD1598 Discontinued
0.7127 Intermediate Similarity NPD5806 Clinical (unspecified phase)
0.7125 Intermediate Similarity NPD1994 Approved
0.7125 Intermediate Similarity NPD1993 Approved
0.7125 Intermediate Similarity NPD1995 Approved
0.712 Intermediate Similarity NPD7394 Phase 2
0.7113 Intermediate Similarity NPD6838 Clinical (unspecified phase)
0.7112 Intermediate Similarity NPD3485 Clinical (unspecified phase)
0.7111 Intermediate Similarity NPD3341 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD6661 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD1027 Approved
0.7101 Intermediate Similarity NPD1029 Clinical (unspecified phase)
0.7101 Intermediate Similarity NPD1030 Approved
0.7098 Intermediate Similarity NPD5426 Phase 3
0.7095 Intermediate Similarity NPD3348 Phase 2
0.7095 Intermediate Similarity NPD5100 Phase 3
0.7086 Intermediate Similarity NPD1313 Approved
0.7083 Intermediate Similarity NPD3015 Discontinued
0.7083 Intermediate Similarity NPD1661 Suspended

Structure

External Identifiers

PubChem CID   6436240
ChEMBL   CHEMBL486306
ZINC  

Physicochemical Properties

Molecular Weight:  264.16
ALogP:  0.4323
MLogP:  3.22
XLogP:  2.734
# Rotatable Bonds:  1
Polar Surface Area:  19.03
# H-Bond Aceptor:  2
# H-Bond Donor:  1
# Rings:  3
# Heavy Atoms:  20

Download Data

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