Drug ID:   | NPD2254 |
Drug Name:   | Artemether |
Molecular Formula:   | C16H26O5 |
Canonical SMILES:   | CO[C@H]1O[C@@H]2O[C@@]3(C)CC[C@@H]4[C@]2([C@H]([C@H]1C)CC[C@H]4C)OO3 |
Standard InCHI:   | InChI=1S/C16H26O5/c1-9-5-6-12-10(2)13(17-4)18-14-16(12)11(9)7-8-15(3,19-14)20-21-16/h9-14H,5-8H2,1-4H3/t9-,10-,11+,12+,13+,14-,15-,16-/m1/s1 |
Standard InCHIKey:   | SXYIRMFQILZOAM-HVNFFKDJSA-N |
Max Developmental Stage:   | Approved |
Max Developmental Stage Source:   | ChEMBL |
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
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7
Similarity Level | Similarity Score | Natural Product ID |
---|---|---|
High Similarity | 1.0 | NPC29005 |
High Similarity | 1.0 | NPC5209 |
High Similarity | 1.0 | NPC51956 |
High Similarity | 0.9275 | NPC53868 |
High Similarity | 0.9275 | NPC209666 |
High Similarity | 0.9275 | NPC31046 |
High Similarity | 0.9275 | NPC200167 |
Intermediate Similarity | 0.8442 | NPC67158 |
Intermediate Similarity | 0.8442 | NPC30102 |
Intermediate Similarity | 0.8442 | NPC128816 |
Intermediate Similarity | 0.8421 | NPC260977 |
Intermediate Similarity | 0.8421 | NPC30443 |
Intermediate Similarity | 0.8421 | NPC285480 |
Intermediate Similarity | 0.8421 | NPC45256 |
Intermediate Similarity | 0.8026 | NPC177343 |
Intermediate Similarity | 0.7821 | NPC60568 |
Intermediate Similarity | 0.7733 | NPC166250 |
Intermediate Similarity | 0.76 | NPC123122 |
Intermediate Similarity | 0.7564 | NPC272841 |
Intermediate Similarity | 0.7531 | NPC241959 |
Intermediate Similarity | 0.75 | NPC308489 |
Intermediate Similarity | 0.7375 | NPC471216 |
Intermediate Similarity | 0.7375 | NPC471217 |
Intermediate Similarity | 0.7349 | NPC290612 |
Intermediate Similarity | 0.7333 | NPC471879 |
Intermediate Similarity | 0.7308 | NPC107963 |
Intermediate Similarity | 0.7284 | NPC71541 |
Intermediate Similarity | 0.7262 | NPC471410 |
Intermediate Similarity | 0.7262 | NPC471411 |
Intermediate Similarity | 0.7209 | NPC131466 |
Intermediate Similarity | 0.7176 | NPC140446 |
Intermediate Similarity | 0.7176 | NPC43912 |
Intermediate Similarity | 0.7143 | NPC476718 |
Intermediate Similarity | 0.7125 | NPC477577 |
Intermediate Similarity | 0.7111 | NPC148872 |
Intermediate Similarity | 0.7108 | NPC470070 |
Intermediate Similarity | 0.7073 | NPC476494 |
Intermediate Similarity | 0.7059 | NPC107603 |
Intermediate Similarity | 0.7059 | NPC268633 |
Intermediate Similarity | 0.7045 | NPC229801 |
Intermediate Similarity | 0.7045 | NPC210759 |
Intermediate Similarity | 0.7045 | NPC307167 |
Intermediate Similarity | 0.7037 | NPC170595 |
Intermediate Similarity | 0.7024 | NPC474156 |
Intermediate Similarity | 0.7011 | NPC82955 |
Intermediate Similarity | 0.7 | NPC132998 |
Remote Similarity | 0.6977 | NPC472396 |
Remote Similarity | 0.6966 | NPC323231 |
Remote Similarity | 0.6966 | NPC171741 |
Remote Similarity | 0.6966 | NPC224003 |
Remote Similarity | 0.6966 | NPC470623 |
Remote Similarity | 0.6966 | NPC18724 |
Remote Similarity | 0.6951 | NPC186588 |
Remote Similarity | 0.6951 | NPC475456 |
Remote Similarity | 0.6933 | NPC477754 |
Remote Similarity | 0.6933 | NPC477761 |
Remote Similarity | 0.6933 | NPC477760 |
Remote Similarity | 0.6933 | NPC477759 |
Remote Similarity | 0.6933 | NPC477758 |
Remote Similarity | 0.6933 | NPC179823 |
Remote Similarity | 0.6932 | NPC261990 |
Remote Similarity | 0.6932 | NPC65550 |
Remote Similarity | 0.6932 | NPC474249 |
Remote Similarity | 0.6932 | NPC279329 |
Remote Similarity | 0.6897 | NPC281004 |
Remote Similarity | 0.6889 | NPC309866 |
Remote Similarity | 0.6889 | NPC305418 |
Remote Similarity | 0.6889 | NPC45959 |
Remote Similarity | 0.6889 | NPC252253 |
Remote Similarity | 0.6889 | NPC267238 |
Remote Similarity | 0.6889 | NPC253611 |
Remote Similarity | 0.6889 | NPC471373 |
Remote Similarity | 0.6889 | NPC77717 |
Remote Similarity | 0.6889 | NPC148593 |
Remote Similarity | 0.6875 | NPC279575 |
Remote Similarity | 0.686 | NPC474008 |
Remote Similarity | 0.6854 | NPC473830 |
Remote Similarity | 0.6854 | NPC289361 |
Remote Similarity | 0.6854 | NPC59006 |
Remote Similarity | 0.6854 | NPC293609 |
Remote Similarity | 0.6854 | NPC204881 |
Remote Similarity | 0.6854 | NPC36372 |
Remote Similarity | 0.6824 | NPC166279 |
Remote Similarity | 0.6824 | NPC18953 |
Remote Similarity | 0.6818 | NPC473472 |
Remote Similarity | 0.6818 | NPC102725 |
Remote Similarity | 0.6813 | NPC106701 |
Remote Similarity | 0.6813 | NPC471425 |
Remote Similarity | 0.6813 | NPC471424 |
Remote Similarity | 0.6813 | NPC471429 |
Remote Similarity | 0.6813 | NPC94582 |
Remote Similarity | 0.6813 | NPC92196 |
Remote Similarity | 0.6813 | NPC189575 |
Remote Similarity | 0.6813 | NPC205129 |
Remote Similarity | 0.6813 | NPC477494 |
Remote Similarity | 0.6813 | NPC57964 |
Remote Similarity | 0.68 | NPC477756 |
Remote Similarity | 0.68 | NPC477764 |
Remote Similarity | 0.68 | NPC477752 |
Remote Similarity | 0.68 | NPC477751 |
Remote Similarity | 0.679 | NPC476719 |
Remote Similarity | 0.6786 | NPC470611 |
Remote Similarity | 0.6778 | NPC144790 |
Remote Similarity | 0.6778 | NPC149400 |
Remote Similarity | 0.6778 | NPC137004 |
Remote Similarity | 0.6778 | NPC172838 |
Remote Similarity | 0.6778 | NPC473726 |
Remote Similarity | 0.6778 | NPC167644 |
Remote Similarity | 0.6778 | NPC88962 |
Remote Similarity | 0.6778 | NPC277774 |
Remote Similarity | 0.6778 | NPC311246 |
Remote Similarity | 0.6742 | NPC473542 |
Remote Similarity | 0.6742 | NPC223143 |
Remote Similarity | 0.6739 | NPC237071 |
Remote Similarity | 0.6739 | NPC304011 |
Remote Similarity | 0.6739 | NPC142264 |
Remote Similarity | 0.6739 | NPC203434 |
Remote Similarity | 0.6739 | NPC476510 |
Remote Similarity | 0.6739 | NPC139271 |
Remote Similarity | 0.6739 | NPC238796 |
Remote Similarity | 0.6709 | NPC470660 |
Remote Similarity | 0.6709 | NPC470659 |
Remote Similarity | 0.6706 | NPC213737 |
Remote Similarity | 0.6706 | NPC475820 |
Remote Similarity | 0.6706 | NPC474346 |
Remote Similarity | 0.6706 | NPC474284 |
Remote Similarity | 0.6706 | NPC474253 |
Remote Similarity | 0.6705 | NPC470872 |
Remote Similarity | 0.6705 | NPC221993 |
Remote Similarity | 0.6703 | NPC30687 |
Remote Similarity | 0.6703 | NPC24960 |
Remote Similarity | 0.6703 | NPC253268 |
Remote Similarity | 0.6703 | NPC178949 |
Remote Similarity | 0.6703 | NPC175 |
Remote Similarity | 0.6703 | NPC291547 |
Remote Similarity | 0.6703 | NPC477224 |
Remote Similarity | 0.6703 | NPC473851 |
Remote Similarity | 0.6703 | NPC312678 |
Remote Similarity | 0.6703 | NPC113500 |
Remote Similarity | 0.6703 | NPC131693 |
Remote Similarity | 0.6703 | NPC174024 |
Remote Similarity | 0.6703 | NPC473503 |
Remote Similarity | 0.6703 | NPC179859 |
Remote Similarity | 0.6703 | NPC475436 |
Remote Similarity | 0.6703 | NPC151214 |
Remote Similarity | 0.6703 | NPC473774 |
Remote Similarity | 0.6703 | NPC191915 |
Remote Similarity | 0.6703 | NPC96736 |
Remote Similarity | 0.6703 | NPC3538 |
Remote Similarity | 0.6667 | NPC476668 |
Remote Similarity | 0.6667 | NPC149966 |
Remote Similarity | 0.6667 | NPC470028 |
Remote Similarity | 0.6667 | NPC477222 |
Remote Similarity | 0.6667 | NPC470836 |
Remote Similarity | 0.6667 | NPC473637 |
Remote Similarity | 0.6667 | NPC233649 |
Remote Similarity | 0.6667 | NPC477223 |
Remote Similarity | 0.6667 | NPC471368 |
Remote Similarity | 0.6667 | NPC5632 |
Remote Similarity | 0.663 | NPC469710 |
Remote Similarity | 0.663 | NPC473067 |
Remote Similarity | 0.663 | NPC473065 |
Remote Similarity | 0.663 | NPC474399 |
Remote Similarity | 0.663 | NPC473064 |
Remote Similarity | 0.6629 | NPC20822 |
Remote Similarity | 0.6627 | NPC477287 |
Remote Similarity | 0.6596 | NPC471374 |
Remote Similarity | 0.6596 | NPC471375 |
Remote Similarity | 0.6596 | NPC209798 |
Remote Similarity | 0.6593 | NPC325828 |
Remote Similarity | 0.6593 | NPC477547 |
Remote Similarity | 0.6593 | NPC250393 |
Remote Similarity | 0.6593 | NPC177834 |
Remote Similarity | 0.6593 | NPC297348 |
Remote Similarity | 0.6593 | NPC477451 |
Remote Similarity | 0.6593 | NPC35164 |
Remote Similarity | 0.6593 | NPC234352 |
Remote Similarity | 0.6593 | NPC249204 |
Remote Similarity | 0.6593 | NPC476669 |
Remote Similarity | 0.6593 | NPC48339 |
Remote Similarity | 0.6593 | NPC141769 |
Remote Similarity | 0.6591 | NPC161928 |
Remote Similarity | 0.6591 | NPC210658 |
Remote Similarity | 0.6591 | NPC110365 |
Remote Similarity | 0.6591 | NPC45833 |
Remote Similarity | 0.6591 | NPC62202 |
Remote Similarity | 0.6591 | NPC213658 |
Remote Similarity | 0.6588 | NPC208912 |
Remote Similarity | 0.6588 | NPC296734 |
Remote Similarity | 0.6588 | NPC2096 |
Remote Similarity | 0.6585 | NPC188793 |
Remote Similarity | 0.6559 | NPC472989 |
Remote Similarity | 0.6559 | NPC296936 |
Remote Similarity | 0.6559 | NPC121453 |
Remote Similarity | 0.6559 | NPC473287 |
Remote Similarity | 0.6559 | NPC252056 |
Remote Similarity | 0.6559 | NPC90583 |
Remote Similarity | 0.6552 | NPC273290 |
Remote Similarity | 0.6552 | NPC232044 |
Remote Similarity | 0.6552 | NPC235402 |
TTD   | |
DrugBank   | DB06697 |
ChEMBL   | CHEMBL566534 |
IUPHAR/BPS   | |
PharmaGKB   | PA165111698 |
KEGG Drug   | D02483 |
PubChem CID   | |
ChEBI   | 195280 |
CAS Number   | 71963-77-4 |
Molecular Weight   | 298.18 |
ALogP   | 0.6572 |
MLogP   | 2.67 |
XLogP   | 3.334 |
HDA   | 5 |
HBD   | 0 |
Rotatable Bonds   | 5 |
TPSA   | 46.15 |
RO5 Violation   | 0 |