Drug ID:   | NPD9425 |
Drug Name:   | Levetiracetam |
Molecular Formula:   | C8H14N2O2 |
Canonical SMILES:   | CC[C@H](N1CCCC1=O)C(=N)O |
Standard InCHI:   | InChI=1S/C8H14N2O2/c1-2-6(8(9)12)10-5-3-4-7(10)11/h6H,2-5H2,1H3,(H2,9,12)/t6-/m0/s1 |
Standard InCHIKey:   | HPHUVLMMVZITSG-LURJTMIESA-N |
Max Developmental Stage:   | Approved |
Max Developmental Stage Source:   | TTD; ChEMBL; IUPHAR/BPS |
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 |
---|---|---|
Intermediate Similarity | 0.75 | NPC84182 |
Intermediate Similarity | 0.75 | NPC128005 |
Intermediate Similarity | 0.7206 | NPC214532 |
Intermediate Similarity | 0.7206 | NPC196007 |
Intermediate Similarity | 0.7206 | NPC76297 |
Intermediate Similarity | 0.7193 | NPC204607 |
Intermediate Similarity | 0.7031 | NPC243964 |
Intermediate Similarity | 0.7 | NPC209156 |
Intermediate Similarity | 0.7 | NPC256312 |
Intermediate Similarity | 0.7 | NPC266888 |
Intermediate Similarity | 0.7 | NPC161774 |
Remote Similarity | 0.6912 | NPC322274 |
Remote Similarity | 0.6761 | NPC126186 |
Remote Similarity | 0.6731 | NPC234196 |
Remote Similarity | 0.6716 | NPC287693 |
Remote Similarity | 0.6714 | NPC470781 |
Remote Similarity | 0.6712 | NPC59867 |
Remote Similarity | 0.6533 | NPC312315 |
Remote Similarity | 0.6438 | NPC327272 |
Remote Similarity | 0.6418 | NPC57420 |
Remote Similarity | 0.6364 | NPC470783 |
Remote Similarity | 0.6364 | NPC475542 |
Remote Similarity | 0.6364 | NPC314510 |
Remote Similarity | 0.6351 | NPC470782 |
Remote Similarity | 0.6324 | NPC262615 |
Remote Similarity | 0.6316 | NPC31756 |
Remote Similarity | 0.6301 | NPC320221 |
Remote Similarity | 0.6234 | NPC476156 |
Remote Similarity | 0.6234 | NPC476117 |
Remote Similarity | 0.6234 | NPC476137 |
Remote Similarity | 0.6234 | NPC476243 |
Remote Similarity | 0.6154 | NPC476302 |
Remote Similarity | 0.6154 | NPC23984 |
Remote Similarity | 0.6076 | NPC84128 |
Remote Similarity | 0.6076 | NPC53858 |
Remote Similarity | 0.6061 | NPC292299 |
Remote Similarity | 0.6061 | NPC34838 |
Remote Similarity | 0.6056 | NPC250953 |
Remote Similarity | 0.6032 | NPC321118 |
Remote Similarity | 0.6032 | NPC316889 |
Remote Similarity | 0.6029 | NPC105297 |
Remote Similarity | 0.6 | NPC235078 |
Remote Similarity | 0.597 | NPC177191 |
Remote Similarity | 0.597 | NPC263207 |
Remote Similarity | 0.5952 | NPC275715 |
Remote Similarity | 0.5946 | NPC29326 |
Remote Similarity | 0.5938 | NPC322573 |
Remote Similarity | 0.5932 | NPC297220 |
Remote Similarity | 0.5926 | NPC472351 |
Remote Similarity | 0.5909 | NPC302003 |
Remote Similarity | 0.5909 | NPC245346 |
Remote Similarity | 0.5909 | NPC11433 |
Remote Similarity | 0.5902 | NPC328378 |
Remote Similarity | 0.5857 | NPC128559 |
Remote Similarity | 0.5846 | NPC38463 |
Remote Similarity | 0.5833 | NPC81647 |
Remote Similarity | 0.5821 | NPC316826 |
Remote Similarity | 0.5821 | NPC317143 |
Remote Similarity | 0.5821 | NPC254541 |
Remote Similarity | 0.5821 | NPC321468 |
Remote Similarity | 0.5821 | NPC327748 |
Remote Similarity | 0.5783 | NPC477539 |
Remote Similarity | 0.5758 | NPC317147 |
Remote Similarity | 0.5758 | NPC278209 |
Remote Similarity | 0.5758 | NPC318260 |
Remote Similarity | 0.5738 | NPC153370 |
Remote Similarity | 0.5735 | NPC329564 |
Remote Similarity | 0.5735 | NPC143722 |
Remote Similarity | 0.5735 | NPC327170 |
Remote Similarity | 0.573 | NPC117829 |
Remote Similarity | 0.5698 | NPC474593 |
Remote Similarity | 0.5698 | NPC475801 |
Remote Similarity | 0.5692 | NPC327831 |
Remote Similarity | 0.5679 | NPC184473 |
Remote Similarity | 0.5679 | NPC6902 |
Remote Similarity | 0.5679 | NPC246005 |
Remote Similarity | 0.5672 | NPC176164 |
Remote Similarity | 0.5672 | NPC189301 |
Remote Similarity | 0.5632 | NPC474576 |
Remote Similarity | 0.5625 | NPC197087 |
Remote Similarity | 0.5625 | NPC274499 |
Remote Similarity | 0.5625 | NPC8488 |
Remote Similarity | 0.5625 | NPC190184 |
Remote Similarity | 0.5625 | NPC333075 |
Remote Similarity | 0.5616 | NPC306696 |
Remote Similarity | 0.5606 | NPC325985 |
TTD   | DAP001489; DAP000502 |
DrugBank   | DB01202 |
ChEMBL   | CHEMBL1286 |
IUPHAR/BPS   | 6826 |
PharmaGKB   | PA450206 |
KEGG Drug   | D00709 |
PubChem CID   | 5284583 |
ChEBI   | 6437 |
CAS Number   | 102767-28-2 |
Molecular Weight   | 170.11 |
ALogP   | -1.3518 |
MLogP   | 1.9 |
XLogP   | 0.502 |
HDA   | 4 |
HBD   | 2 |
Rotatable Bonds   | 5 |
TPSA   | 64.39 |
RO5 Violation   | 0 |