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"babel --append ..." Command - Calculate Molecule Properties
How to use "babel --append ..." command to calculate Molecule Properties? The "--append ..." option of the "babel" command can be used to copy existing molecule properties from the input data source, and append them to the "title" field of output molecules. But the "--append ..." option can also be ...
2020-12-26, 2155🔥, 0💬

Molecule FYI-1005507
Molecule Summary: ID: FYI-1005507 Names: InChIKey: FFGPTBGBLSHEPO-UHFFFAOYSA-N SMILES: NC(=O)n3c1ccccc1ccc2ccccc23 Received at FYIcenter.com on: 2023-11-01
2023-11-09, 2154🔥, 0💬

Molecule FYI-1001196
Molecule Summary: ID: FYI-1001196 SMILES: CC(=O)N[C@@H]1[C@@H](O)[C@H](O )[C@@H](CO)O[C@@H]1OP(O)(=O)OP (O)(=O)OC[C@H]1O[C@H]([C@H](O) [C@@H]1O)n1ccc(=O)[nH]c1=OReceived at FYIcenter.com on: 2022-03-03
2022-04-21, 2154🔥, 0💬

Molecule FYI-1006515
Molecule Summary: ID: FYI-1006515 Names: InChIKey: UCYPOAPUDLUXQX-HZJYTTRNSA-N SMILES: CCCCC/C=C\\C\\C=C/CCCCCCCCCCCC (=O)OCC(O)COReceived at FYIcenter.com on: 2023-12-31
2024-01-10, 2152🔥, 0💬

Molecule FYI-1003736
Molecule Summary: ID: FYI-1003736 Names: InChIKey: SOZSUYGVBDXLLZ-HSMPPUOJSA-N SMILES: CCCCC/C=C/CCCCCCC[C@@H](O)[C@@ H](O)[C@H](CO)NC(=O)[C@H](O)CC CCCCCCCCCCCCCCCCCCCCReceived at FYIcenter.com on: 2023-07-24
2023-08-03, 2152🔥, 0💬

Molecule FYI-1002243
Molecule Summary: ID: FYI-1002243 Names: InChIKey: APRWCSIYQDCBJS-PIBDHAAFSA-O SMILES: Cc2nc1c(N)ncnc1n2[C@@H]3O[C@H] (C[S+](C)CC[C@H](N)C(=O)O)[C@@ H](O)[C@H]3OReceived at FYIcenter.com on: 2023-02-10
2023-03-07, 2152🔥, 0💬

Molecule FYI-1004650
Molecule Summary: ID: FYI-1004650 Names: InChIKey: XZKGPCWOQSSJNU-QWQIAVHNSA-N SMILES: C/C=C(C)\\C(=O)OC[C@H]1[C@@H]( C)CO[C@@H]1c2cc(OC)c(OC)c(OC)c 2.COc1ccc(C)cc1OCReceived at FYIcenter.com on: 2023-09-18
2023-09-23, 2151🔥, 0💬

Molecule FYI-1004023
Molecule Summary: ID: FYI-1004023 Names: InChIKey: UIZVIJUGNWTATG-UHFFFAOYSA-N SMILES: COc3ccc(CSc2nnc(c1cccnc1)o2)cc 3Received at FYIcenter.com on: 2023-08-08
2023-08-17, 2151🔥, 0💬

Molecule FYI-1002576
Molecule Summary: ID: FYI-1002576 Names: InChIKey: CMKRJYIQUHSGDQ-UHFFFAOYSA-N SMILES: O=c2c1ccccc1c6c2c(c3cccnc3)nc5 ccc4ccccc4c56Received at FYIcenter.com on: 2023-04-10
2023-04-25, 2151🔥, 0💬

Molecule FYI-1004775
Molecule Summary: ID: FYI-1004775 Names: InChIKey: OJSKJQFODPKTBT-MSYPJMGYSA-N SMILES: C=C[C@@]3(C)C=C2CCC1[C@@](C)(C O)[C@H](O)CC[C@@]1(C)[C@@H]2CC 3Received at FYIcenter.com on: 2023-09-23
2023-10-05, 2149🔥, 0💬

Molecule FYI-1001172
Molecule Summary: ID: FYI-1001172 SMILES: CC(C)(C)O Received at FYIcenter.com on: 2022-02-14
2022-04-21, 2149🔥, 0💬

Molecule FYI-1005663
Molecule Summary: ID: FYI-1005663 Names: InChIKey: URBKETJPLVPCMB-UHFFFAOYSA-N SMILES: O=Cc5cccc(c3nnc4n(Cc1ccccc1Cl) c(=O)c2ccccc2n34)c5Received at FYIcenter.com on: 2023-11-09
2023-11-23, 2148🔥, 0💬

Molecule FYI-1003123
Molecule Summary: ID: FYI-1003123 Names: InChIKey: WPXMOQUGUPKMMM-HEHNFIMWSA-N SMILES: COC(=O)CCCCOC/1OC(COC(C)=O)C(O C(C)=O)C(OC(C)=O)C1=N/C(C)=OReceived at FYIcenter.com on: 2023-05-12
2023-06-12, 2148🔥, 0💬

Molecule FYI-1001319
Molecule Summary: ID: FYI-1001319 SMILES: CCCCC(CC)CN=C(N)NC(=NCCCCCCN=C (N)NC(=NCC(CC)CCCC)N)N.Cl.ClReceived at FYIcenter.com on: 2022-05-15
2022-07-01, 2148🔥, 0💬

Molecule FYI-1004125
Molecule Summary: ID: FYI-1004125 Names: InChIKey: VKHMGHGADHGCDO-UHFFFAOYSA-O SMILES: CCC(CC(C)C(=O)OCC[N+](C)(C)Cc1 ccccc1)C(N)=OReceived at FYIcenter.com on: 2023-08-15
2023-08-25, 2147🔥, 0💬

Molecule FYI-1003563
Molecule Summary: ID: FYI-1003563 Names: InChIKey: CITJOFXPPYFWBO-UHFFFAOYSA-N SMILES: O=c5c4cc3c(=O)n(c2ccc(Oc1ccc(I )cc1)cc2)c(=O)c3cc4c(=O)n5FReceived at FYIcenter.com on: 2023-07-03
2023-08-09, 2147🔥, 0💬

Molecule FYI-1005867
Molecule Summary: ID: FYI-1005867 Names: InChIKey: QDYMKXZHPGKQHR-UHFFFAOYSA-N SMILES: O=C(NCCN1CCOCC1)c4cc3[nH]c(=O) c2ccccc2n3n4Received at FYIcenter.com on: 2023-11-17
2023-11-25, 2146🔥, 0💬

Molecule FYI-1003928
Molecule Summary: ID: FYI-1003928 Names: InChIKey: PZNVTVNGEXMHQG-PGGSIGJZSA-L SMILES: Cl[Sn]4(c1ccccc1)(c2ccccc2)Oc3 ccc(Br)cc3C=[N+]4Nc5ccccc5Received at FYIcenter.com on: 2023-08-05
2023-08-09, 2146🔥, 0💬

Molecule FYI-1004637
Molecule Summary: ID: FYI-1004637 Names: InChIKey: ZJJQZOYSSCWSIH-JOCHJYFZSA-N SMILES: CC(C)n1cnnc1S(=O)CC(=O)Nc2cc(C l)ccc2FReceived at FYIcenter.com on: 2023-09-15
2023-09-23, 2145🔥, 0💬

Molecule FYI-1004328
Molecule Summary: ID: FYI-1004328 Names: InChIKey: GOPBXSCNRUABTG-UHFFFAOYSA-N SMILES: SCCCCCl Received at FYIcenter.com on: 2023-08-30
2023-09-07, 2145🔥, 0💬

Molecule FYI-1003937
Molecule Summary: ID: FYI-1003937 Names: InChIKey: SSNQVLONLVSAFF-UHFFFAOYSA-N SMILES: CCCOc3ccc(c2ccc1[nH]ccc1c2)cc3 Received at FYIcenter.com on: 2023-08-07
2023-08-09, 2145🔥, 0💬

Molecule FYI-1003965
Molecule Summary: ID: FYI-1003965 Names: InChIKey: FEEGDJIDWHFIEW-UHFFFAOYSA-N SMILES: C=C(CCc2n[nH]c(c1ccc(OCCOCC)cc 1)nc2=O)NC3CCCCC3Received at FYIcenter.com on: 2023-08-08
2023-09-05, 2144🔥, 0💬

Molecule FYI-1004078
Molecule Summary: ID: FYI-1004078 Names: InChIKey: OBGBGHKYJAOXRR-UHFFFAOYSA-N SMILES: COc2cc(=O)c1ccccc1c2=O Received at FYIcenter.com on: 2023-08-10
2023-09-05, 2144🔥, 0💬

Molecule FYI-1002548
Molecule Summary: ID: FYI-1002548 Names: InChIKey: HUOSKZIQSONQEL-UHFFFAOYSA-N SMILES: O=C(Nc2ccc1OCOc1c2)c3ccccc3NC( =O)c4ccc(F)cc4FReceived at FYIcenter.com on: 2023-04-10
2023-04-13, 2144🔥, 0💬

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