Atom Biology General Molecule Reaction Tools Trial Virus

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Molecule FYI-1002203
Molecule Summary: ID: FYI-1002203 Names: InChIKey: AFWMZUCZYVDLHN-VVJWNWSFSA-N SMILES: O=C2c1ccccc1C(=O)C27C(c3cccc4c cccc34)C(N(=O)=O)C(c5ccccc5)C6 CCCCC67OReceived at FYIcenter.com on: 2023-02-05 2023-02-28, 898🔥, 0💬

Molecule FYI-1000355
Molecule Summary: ID: FYI-1000355 SMILES: CC(=)NC1==CC=C(O)C=C1 Received at FYIcenter.com on: 2021-04-14 2021-05-16, 897🔥, 0💬

Molecule FYI-1000276
Molecule Summary: ID: FYI-1000276 SMILES: CC[C@H](C)O Received at FYIcenter.com on: 2021-03-02 2021-04-15, 896🔥, 0💬

Molecule FYI-1000302
Molecule Summary: ID: FYI-1000302 SMILES: O=C(OCC(CN=[N+]=[N-])(CN=[N+]= [N-])COC(CCC)=O)CCCReceived at FYIcenter.com on: 2021-03-29 2022-05-31, 895🔥, 0💬

"babel -ofpt -xs" - Display Fingerprint Fragments
How to Display Fingerprint Fragments using "babel" command? I want to know how many fragments are used when taking the fingerprint of a given molecule. You can using ""-ofpt -xs" options of the "babel" command to Display Fingerprint Fragment information. Here are some examples of molecule fingerprin... 2020-12-02, 894🔥, 0💬

Molecule FYI-1000298
Molecule Summary: ID: FYI-1000298 SMILES: NC(=O)c1cccncc1 Received at FYIcenter.com on: 2021-03-21 2022-05-31, 893🔥, 0💬

"obfit" - Superimpose Two Molecules
What Is "obfit" command? How to use it to Superimpose Two Molecules? "obfit" command is a command line tool provided in the Open Babel package that allows you to Superimpose Two Molecules. Here is the user manual of the "obfit" command. NAME obfit -- superimpose two molecules based on a pattern SYNO... 2020-11-11, 893🔥, 0💬

Molecule FYI-1002532
Molecule Summary: ID: FYI-1002532 Names: InChIKey: WKXPQJNIIYFTPC-OAQYLSRUSA-N SMILES: CC(C)Nc4cc(c3ccc2c(C(=O)N[C@H] (CO)c1cccc(Cl)c1)nn(C)c2c3)ccn 4Received at FYIcenter.com on: 2023-04-08 2023-04-13, 890🔥, 0💬

Molecule FYI-1003436
Molecule Summary: ID: FYI-1003436 Names: InChIKey: YSUUIPAGPVQNSM-UHFFFAOYSA-N SMILES: COc1ccc2c(c1)nc3n2[Mg]8([O+]=S 3Cc4ncc(C)c(OC)c4C)[O+]=S(Cc5n cc(C)c(OC)c5C)c7nc6cc(OC)ccc6n 78Received at FYIcenter.com on: 2023-06-18 2023-07-01, 889🔥, 0💬

Molecule FYI-1000379
Molecule Summary: ID: FYI-1000379 SMILES: Oc1cc(O)c2c(c1)OC(c1ccc(O)c(O) c1)C(OC1(c3ccc(O)c(O)c3)Oc3cc( O)cc(O)c3C(O)C1O)C2Received at FYIcenter.com on: 2021-04-20 2021-05-04, 888🔥, 0💬

Molecule FYI-1000960
Molecule Summary: ID: FYI-1000960 SMILES: COc1cc(CCC(=O)/C=C/CCc2cc(OC)c (O)c(OC)c2)ccc1OReceived at FYIcenter.com on: 2021-08-15 2021-10-02, 886🔥, 0💬

Molecule FYI-1000282
Molecule Summary: ID: FYI-1000282 SMILES: C1CCCC2(CCC1)CCCC2 Received at FYIcenter.com on: 2021-03-03 2021-04-17, 886🔥, 0💬

Molecule FYI-1002030
Molecule Summary: ID: FYI-1002030 Names: METHANE; InChIKey: VNWKTOKETHGBQD-UHFFFAOYSA-N SMILES: C Received at FYIcenter.com on: 2023-01-19 2023-01-20, 883🔥, 0💬

Molecule FYI-1000335
Molecule Summary: ID: FYI-1000335 SMILES: C[C@@](c1cc(cc(c1)F)F)(C(=O)OC )NC[C@H]2CCCO2Received at FYIcenter.com on: 2021-04-05 2022-07-26, 883🔥, 0💬

Molecule FYI-1000356
Molecule Summary: ID: FYI-1000356 SMILES: CC(=O)NC1==CC=C(O)C=C1 Received at FYIcenter.com on: 2021-04-14 2021-05-16, 883🔥, 0💬

Molecule FYI-1000951
Molecule Summary: ID: FYI-1000951 SMILES: CCCCCC1=CC(=C(C(=C1)O)C2C=C(CC C2C(=C)C)C)OReceived at FYIcenter.com on: 2021-07-28 2021-11-01, 882🔥, 1💬

Molecule FYI-1000456
Molecule Summary: ID: FYI-1000456 SMILES: CCN(CCCC(C)NC1=C2C=CC(=CC2=NC= C1)Cl)CCOReceived at FYIcenter.com on: 2021-07-12 2021-10-02, 881🔥, 0💬

JSME Molecule Editor at FYIcenter.com
What is JSME Molecule Editor at FYIcenter.com? FYIcenter.com maintains a version of JSME Molecule Editor. You can use it to create a new molecule, or edit an existing molecule. JSME, Molecule Editor in JavaScript is a free molecule editor created by Peter Ertl and Bruno Bienfait. It can be used as a... 2021-08-13, 881🔥, 0💬

Molecule FYI-1000271
Molecule Summary: ID: FYI-1000271 SMILES: N[C@@](F)([12C])C(=O)O Received at FYIcenter.com on: 2021-02-25 2021-04-15, 881🔥, 0💬

What Is PK-PD Relation
What Is PK-PD (Pharmacokinetic-Pharmacodynam ic)relation? Since PK is mainly represented as a function of drug concentration over time, and PD is mainly represented as a function of drug efficacy over drug concentration, the PK-PD relation is represented as a function of by drug efficacy over time b... 2021-11-01, 880🔥, 1💬

What Is PKNCA R Package
What Is the PKNCA R Package? The PKNCA R Package is designed to perform all Non-Compartmental Analysis (NCA) calculations for Pharmacokinetic (PK) data. The primary and secondary goals of the PKNCA package are to 1) only give correct answers to the specific questions being asked and 2) automate as m... 2021-06-20, 880🔥, 0💬

Molecule FYI-1000278
Molecule Summary: ID: FYI-1000278 SMILES: OC(C)CO Received at FYIcenter.com on: 2021-03-03 2021-04-17, 880🔥, 0💬

Molecule FYI-1002253
Molecule Summary: ID: FYI-1002253 Names: InChIKey: CVLAEVBLXBFKCE-UHFFFAOYSA-N SMILES: CC3=CC(O)C2=C(C)C1=C(O)CC(=O)C 4C1c6c2c3c8C(C)=CC(O)C7=C(C)C5 C(O)=CC(=O)C4C5c6c78Received at FYIcenter.com on: 2023-02-12 2023-03-07, 878🔥, 0💬

Molecule FYI-1000273
Molecule Summary: ID: FYI-1000273 SMILES: C1CC(C1)O Received at FYIcenter.com on: 2021-02-26 2021-04-15, 878🔥, 0💬

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Atom Biology General Molecule Reaction Tools Trial Virus