Drug ID:   | NPD8785 |
Drug Name:   | Glutamine |
Molecular Formula:   | C5H10N2O3 |
Canonical SMILES:   | OC(=N)CC[C@@H](C(=O)O)N |
Standard InCHI:   | InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1 |
Standard InCHIKey:   | ZDXPYRJPNDTMRX-VKHMYHEASA-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 | NPC190184 |
High Similarity | 1.0 | NPC197087 |
High Similarity | 0.9412 | NPC38463 |
High Similarity | 0.9412 | NPC325985 |
High Similarity | 0.8889 | NPC321536 |
High Similarity | 0.8846 | NPC322573 |
High Similarity | 0.8727 | NPC143722 |
Intermediate Similarity | 0.8431 | NPC137958 |
Intermediate Similarity | 0.8431 | NPC273330 |
Intermediate Similarity | 0.8276 | NPC289691 |
Intermediate Similarity | 0.8163 | NPC327698 |
Intermediate Similarity | 0.8163 | NPC118459 |
Intermediate Similarity | 0.8136 | NPC174304 |
Intermediate Similarity | 0.8136 | NPC325597 |
Intermediate Similarity | 0.8039 | NPC153370 |
Intermediate Similarity | 0.8039 | NPC140872 |
Intermediate Similarity | 0.8039 | NPC93081 |
Intermediate Similarity | 0.7925 | NPC19576 |
Intermediate Similarity | 0.7925 | NPC29950 |
Intermediate Similarity | 0.7895 | NPC254541 |
Intermediate Similarity | 0.7895 | NPC317143 |
Intermediate Similarity | 0.7895 | NPC327748 |
Intermediate Similarity | 0.7895 | NPC321468 |
Intermediate Similarity | 0.7895 | NPC316826 |
Intermediate Similarity | 0.7895 | NPC320598 |
Intermediate Similarity | 0.7885 | NPC112890 |
Intermediate Similarity | 0.7885 | NPC316231 |
Intermediate Similarity | 0.7885 | NPC324825 |
Intermediate Similarity | 0.7869 | NPC118524 |
Intermediate Similarity | 0.7818 | NPC2801 |
Intermediate Similarity | 0.78 | NPC329263 |
Intermediate Similarity | 0.7778 | NPC263065 |
Intermediate Similarity | 0.7778 | NPC189178 |
Intermediate Similarity | 0.7759 | NPC327170 |
Intermediate Similarity | 0.7759 | NPC329564 |
Intermediate Similarity | 0.7742 | NPC319046 |
Intermediate Similarity | 0.7719 | NPC176164 |
Intermediate Similarity | 0.7719 | NPC189301 |
Intermediate Similarity | 0.7647 | NPC297220 |
Intermediate Similarity | 0.7619 | NPC126779 |
Intermediate Similarity | 0.7547 | NPC84636 |
Intermediate Similarity | 0.7547 | NPC62045 |
Intermediate Similarity | 0.7547 | NPC226027 |
Intermediate Similarity | 0.7547 | NPC245027 |
Intermediate Similarity | 0.7547 | NPC162620 |
Intermediate Similarity | 0.7547 | NPC43204 |
Intermediate Similarity | 0.7547 | NPC174246 |
Intermediate Similarity | 0.7544 | NPC318260 |
Intermediate Similarity | 0.7544 | NPC317147 |
Intermediate Similarity | 0.7458 | NPC68974 |
Intermediate Similarity | 0.7407 | NPC327239 |
Intermediate Similarity | 0.7347 | NPC168375 |
Intermediate Similarity | 0.7347 | NPC326992 |
Intermediate Similarity | 0.7347 | NPC121517 |
Intermediate Similarity | 0.7321 | NPC316889 |
Intermediate Similarity | 0.7321 | NPC321118 |
Intermediate Similarity | 0.7222 | NPC328378 |
Intermediate Similarity | 0.7213 | NPC327252 |
Intermediate Similarity | 0.7193 | NPC327831 |
Intermediate Similarity | 0.7143 | NPC325534 |
Intermediate Similarity | 0.7059 | NPC167986 |
Intermediate Similarity | 0.7059 | NPC276294 |
Intermediate Similarity | 0.7059 | NPC291186 |
Intermediate Similarity | 0.7018 | NPC183845 |
Intermediate Similarity | 0.7018 | NPC279661 |
Remote Similarity | 0.6964 | NPC322946 |
Remote Similarity | 0.6949 | NPC278209 |
Remote Similarity | 0.6939 | NPC18188 |
Remote Similarity | 0.6923 | NPC325097 |
Remote Similarity | 0.6923 | NPC132307 |
Remote Similarity | 0.6923 | NPC323974 |
Remote Similarity | 0.6923 | NPC126925 |
Remote Similarity | 0.6852 | NPC136159 |
Remote Similarity | 0.6842 | NPC329495 |
Remote Similarity | 0.6825 | NPC106216 |
Remote Similarity | 0.6825 | NPC88898 |
Remote Similarity | 0.6786 | NPC319175 |
Remote Similarity | 0.6774 | NPC118429 |
Remote Similarity | 0.6719 | NPC50047 |
Remote Similarity | 0.6667 | NPC66043 |
Remote Similarity | 0.6667 | NPC49952 |
Remote Similarity | 0.6667 | NPC326212 |
Remote Similarity | 0.6667 | NPC53449 |
Remote Similarity | 0.6667 | NPC136476 |
Remote Similarity | 0.6667 | NPC237525 |
Remote Similarity | 0.6618 | NPC328457 |
Remote Similarity | 0.6613 | NPC321419 |
Remote Similarity | 0.6562 | NPC226453 |
Remote Similarity | 0.6562 | NPC103130 |
Remote Similarity | 0.6562 | NPC315744 |
Remote Similarity | 0.6557 | NPC190385 |
Remote Similarity | 0.6557 | NPC11433 |
Remote Similarity | 0.6557 | NPC302003 |
Remote Similarity | 0.6557 | NPC245346 |
Remote Similarity | 0.6545 | NPC101249 |
Remote Similarity | 0.6531 | NPC272614 |
Remote Similarity | 0.6531 | NPC21290 |
Remote Similarity | 0.6531 | NPC116709 |
Remote Similarity | 0.6522 | NPC315897 |
Remote Similarity | 0.6515 | NPC222327 |
Remote Similarity | 0.6515 | NPC188231 |
Remote Similarity | 0.6491 | NPC125736 |
Remote Similarity | 0.6481 | NPC285322 |
Remote Similarity | 0.6481 | NPC208793 |
Remote Similarity | 0.6462 | NPC278881 |
Remote Similarity | 0.6452 | NPC276928 |
Remote Similarity | 0.6452 | NPC268927 |
Remote Similarity | 0.6452 | NPC64250 |
Remote Similarity | 0.6441 | NPC322091 |
Remote Similarity | 0.6441 | NPC60672 |
Remote Similarity | 0.64 | NPC69179 |
Remote Similarity | 0.64 | NPC63621 |
Remote Similarity | 0.6379 | NPC200550 |
Remote Similarity | 0.6379 | NPC155156 |
Remote Similarity | 0.6364 | NPC309658 |
Remote Similarity | 0.6364 | NPC185755 |
Remote Similarity | 0.6364 | NPC327985 |
Remote Similarity | 0.6364 | NPC213876 |
Remote Similarity | 0.6316 | NPC270805 |
Remote Similarity | 0.6316 | NPC152451 |
Remote Similarity | 0.6316 | NPC193989 |
Remote Similarity | 0.6316 | NPC93888 |
Remote Similarity | 0.6316 | NPC170739 |
Remote Similarity | 0.6296 | NPC198301 |
Remote Similarity | 0.625 | NPC181588 |
Remote Similarity | 0.6207 | NPC315977 |
Remote Similarity | 0.6207 | NPC50457 |
Remote Similarity | 0.6176 | NPC81647 |
Remote Similarity | 0.614 | NPC227850 |
Remote Similarity | 0.614 | NPC327542 |
Remote Similarity | 0.6119 | NPC470108 |
Remote Similarity | 0.6102 | NPC202525 |
Remote Similarity | 0.6102 | NPC155512 |
Remote Similarity | 0.6094 | NPC177191 |
Remote Similarity | 0.6087 | NPC472579 |
Remote Similarity | 0.6087 | NPC133183 |
Remote Similarity | 0.6081 | NPC314680 |
Remote Similarity | 0.6056 | NPC55274 |
Remote Similarity | 0.6029 | NPC470109 |
Remote Similarity | 0.6 | NPC245768 |
Remote Similarity | 0.6 | NPC317815 |
Remote Similarity | 0.5972 | NPC476248 |
Remote Similarity | 0.5965 | NPC204364 |
Remote Similarity | 0.5946 | NPC59867 |
Remote Similarity | 0.5942 | NPC470110 |
Remote Similarity | 0.5932 | NPC114990 |
Remote Similarity | 0.5926 | NPC326808 |
Remote Similarity | 0.5926 | NPC226265 |
Remote Similarity | 0.5926 | NPC254482 |
Remote Similarity | 0.5926 | NPC110533 |
Remote Similarity | 0.5926 | NPC317691 |
Remote Similarity | 0.5926 | NPC219143 |
Remote Similarity | 0.5882 | NPC287693 |
Remote Similarity | 0.5882 | NPC9294 |
Remote Similarity | 0.5857 | NPC322274 |
Remote Similarity | 0.5849 | NPC327250 |
Remote Similarity | 0.5821 | NPC57420 |
Remote Similarity | 0.5806 | NPC102815 |
Remote Similarity | 0.5806 | NPC10915 |
Remote Similarity | 0.5797 | NPC78312 |
Remote Similarity | 0.5797 | NPC60424 |
Remote Similarity | 0.5797 | NPC221764 |
Remote Similarity | 0.5797 | NPC314221 |
Remote Similarity | 0.5797 | NPC135539 |
Remote Similarity | 0.5797 | NPC196359 |
Remote Similarity | 0.5789 | NPC198196 |
Remote Similarity | 0.5789 | NPC306238 |
Remote Similarity | 0.5789 | NPC248970 |
Remote Similarity | 0.5769 | NPC84128 |
Remote Similarity | 0.5769 | NPC53858 |
Remote Similarity | 0.5763 | NPC17244 |
Remote Similarity | 0.5758 | NPC322206 |
Remote Similarity | 0.5758 | NPC477644 |
Remote Similarity | 0.5714 | NPC107224 |
Remote Similarity | 0.5714 | NPC43264 |
Remote Similarity | 0.569 | NPC316168 |
Remote Similarity | 0.5667 | NPC319110 |
Remote Similarity | 0.5667 | NPC329181 |
Remote Similarity | 0.5658 | NPC37681 |
Remote Similarity | 0.5641 | NPC475542 |
Remote Similarity | 0.5641 | NPC314466 |
Remote Similarity | 0.5634 | NPC15864 |
Remote Similarity | 0.56 | NPC114517 |
Remote Similarity | 0.56 | NPC125575 |
Molecular Weight   | 146.07 |
ALogP   | -1.4816 |
MLogP   | 1.46 |
XLogP   | -2.943 |
HDA   | 5 |
HBD   | 4 |
Rotatable Bonds   | 7 |
TPSA   | 107.4 |
RO5 Violation   | 0 |