Atom Biology General Molecule Reaction Tools Trial Virus

<< < … 15 16 17 18 19 20 21 22 23 24 25 … > >>   ∑:7660  Sort:Date

Molecule FYI-1002859
Molecule Summary: ID: FYI-1002859 Names: InChIKey: HZSYWLUXRWAWOM-UHFFFAOYSA-N SMILES: NS(=O)(=O)c1cc(C(=O)NCCCO)c(Cl )cc1NCc2ccccc2Received at FYIcenter.com on: 2023-04-24 2023-05-09, 736🔥, 0💬

Molecule FYI-1003901
Molecule Summary: ID: FYI-1003901 Names: InChIKey: BGMRTOQAAVHUOW-CSKARUKUSA-N SMILES: CCOC(=O)/C=C/C5CN(C4CCN(c3ccc( Nc2nc(NC1CCOCC1)c(CC)nc2C(N)=O )cc3OC)CC4)CCN5CReceived at FYIcenter.com on: 2023-08-04 2023-08-09, 734🔥, 0💬

Hash Bond with Solid Line
Why Hash Bond with a Solid Line used by Open Babel? Sometimes, when a hash bond is located on a ring structure, Open Babel adds a solid line to the hash bond. Here is an example SDF/Mol file, Hash-with-Solid-Line.sdf, that has 4 stereo centers on a ring structure. Hash-with-Solid-Line FYICenter.com ... 2022-07-26, 734🔥, 0💬

Molecule FYI-1000324
Molecule Summary: ID: FYI-1000324 SMILES: C[C@@](c1cc(cc(c1)F)F)(C(=O)OC )NReceived at FYIcenter.com on: 2021-04-05 2022-07-26, 733🔥, 0💬

Molecule FYI-1000322
Molecule Summary: ID: FYI-1000322 SMILES: C[C@@H](Cn1cccn1)N[C@H]2CCOC2= OReceived at FYIcenter.com on: 2021-04-05 2022-07-26, 732🔥, 0💬

Molecule FYI-1000310
Molecule Summary: ID: FYI-1000310 SMILES: Cn1ccnc(c1=O)NC(=O)[C@@H]2CC(= O)N(C2)CCc3ccccc3Received at FYIcenter.com on: 2021-04-05 2022-07-26, 732🔥, 0💬

Molecule FYI-1001098
Molecule Summary: ID: FYI-1001098 SMILES: C1=C[CH-]C=C1.C=1C=C[CH-]C1.[F e+2]Received at FYIcenter.com on: 2021-12-25 2022-02-04, 732🔥, 0💬

Molecule FYI-1000384
Molecule Summary: ID: FYI-1000384 SMILES: C/C(C)=C\\CC/C(C)=C/CC/C(C)=C/ CCC(C)=OReceived at FYIcenter.com on: 2021-04-30 2021-10-10, 732🔥, 0💬

Molecule FYI-1000462
Molecule Summary: ID: FYI-1000462 SMILES: C1[C@@H]([C@H](C2(O1)C3[C@@]45 C[C@@](O2)([C@]6([C@@]([C@@H]4 C7=C(O6)C(=C(C=C7C(=O)O[C@@H]8 [C@@H]9[C@@H]([C@@H](COC(=O)C1 =CC(=C(C(=C1C1=C(C(=C(C=C1C(=O )O9)O)O)O)O)O)O)O[C@H]8OC(=O)C 1=CC(=C(C(=C1)O)O)O)OC5=O)O)O) (O3)O)O)O)O)OReceived at FYIcenter.com on: 2021... 2021-08-01, 732🔥, 0💬

Molecule FYI-1003939
Molecule Summary: ID: FYI-1003939 Names: InChIKey: LPYXADUZSWBHCT-UHFFFAOYSA-N SMILES: c3ccc(c2ccc1[nH]ccc1c2)cc3 Received at FYIcenter.com on: 2023-08-07 2023-08-09, 731🔥, 0💬

Molecule FYI-1003295
Molecule Summary: ID: FYI-1003295 Names: InChIKey: QWHMTKSHPVFPHE-UHFFFAOYSA-N SMILES: COc3cccc(c2ncc(c1ccccc1O)o2)c3 OCReceived at FYIcenter.com on: 2023-05-31 2023-06-19, 731🔥, 0💬

Molecule FYI-1000994
Molecule Summary: ID: FYI-1000994 SMILES: Received at FYIcenter.com on: 2021-09-13 2021-12-28, 731🔥, 0💬

Molecule FYI-1002257
Molecule Summary: ID: FYI-1002257 Names: InChIKey: AVYKQOAMZCAHRG-UHFFFAOYSA-N SMILES: CCO[Si](CCC(F)(F)C(F)(F)C(F)(F )C(F)(F)C(F)(F)C(F)(F)F)(OCC)O CCReceived at FYIcenter.com on: 2023-02-12 2023-03-07, 730🔥, 0💬

Molecule FYI-1002013
Molecule Summary: ID: FYI-1002013 Names: InChIKey: RZTAMFZIAATZDJ-UHFFFAOYSA-N SMILES: CCOC(=O)/C1=C(C)/N/C(C)=C(C(=O )OC)\\C1c2cccc(Cl)c2ClReceived at FYIcenter.com on: 2023-01-18 2023-01-18, 730🔥, 0💬

Molecule FYI-1000313
Molecule Summary: ID: FYI-1000313 SMILES: O=C(Nc1nccs1)CCC(=O)O[C@H]1C[C @@H]2C[C@H]1CC2Received at FYIcenter.com on: 2021-04-05 2022-07-26, 730🔥, 0💬

Molecule FYI-1001167
Molecule Summary: ID: FYI-1001167 SMILES: Oc1ccccc1C1=NNC(=S)N1N Received at FYIcenter.com on: 2022-02-11 2022-07-01, 730🔥, 0💬

Molecule FYI-1002228
Molecule Summary: ID: FYI-1002228 Names: InChIKey: SQHQSJTXZGDBSC-UHFFFAOYSA-N SMILES: COc2cccc(C=CC(=O)Nc1nnn(CCC=O) n1)c2Received at FYIcenter.com on: 2023-02-05 2023-02-28, 729🔥, 0💬

Molecule FYI-1001914
Molecule Summary: ID: FYI-1001914 SMILES: S[C@@H](C(N[C@H]1C(N2[C@@H](CC C[C@H]2SCC1)C(OC)=O)=O)=O)CC3= CC=CC=C3Received at FYIcenter.com on: 2022-12-30 2023-01-08, 729🔥, 0💬

Read Stereoinformation from Input
How stereoinformation is being read from input data by Open Babel? Most molecule data files store stereoinformation in 3 ways: 0D, 2D, and 3D. 0D: Stereoinformation in 0 dimension is defined by parity (or chirality) at atom level. 2D: Stereoinformation in 2 dimension is defined by bond style as wedg... 2022-11-16, 729🔥, 0💬

Molecule FYI-1000325
Molecule Summary: ID: FYI-1000325 SMILES: C[C@@](c1cccc(c1)Br)(C(=O)OC)N Received at FYIcenter.com on: 2021-04-05 2022-07-26, 729🔥, 0💬

Molecule FYI-1000975
Molecule Summary: ID: FYI-1000975 SMILES: S=C1S/C(=C/c2ccc(CC)cc2)C(=O)N 1CCN(CC)CCReceived at FYIcenter.com on: 2021-08-20 2021-12-28, 729🔥, 0💬

Molecule FYI-1000382
Molecule Summary: ID: FYI-1000382 SMILES: O=C(O)c1ccc(Cl)nc1Cl Received at FYIcenter.com on: 2021-04-30 2021-10-10, 729🔥, 0💬

Molecule FYI-1000336
Molecule Summary: ID: FYI-1000336 SMILES: CC(=C)C1CCC2(C1C3CCC4C5(CCC(=O )C(C5CCC4(C3(CC2)C)C)(C)C)C)CReceived at FYIcenter.com on: 2021-04-06 2022-07-26, 728🔥, 0💬

Molecule FYI-1002097
Molecule Summary: ID: FYI-1002097 Names: InChIKey: FZERHIULMFGESH-UHFFFAOYSA-N SMILES: CC(=O)Nc1ccccc1 Received at FYIcenter.com on: 2023-01-29 2023-02-19, 727🔥, 0💬

<< < … 15 16 17 18 19 20 21 22 23 24 25 … > >>   ∑:7660  Sort:Date

Atom Biology General Molecule Reaction Tools Trial Virus