12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid

C130H98N18O26S12 — CID 159001578

IUPAC12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid
SMILESCCSc1nc2cc3cc4ccccc4[nH]c3cc2n1.CCSc1nc2cc3nc4ccccc4nc3cc2s1.CCSc1nc2cc3ncccc3cc2n1CC.Cc1nc2cc3c(cc2n1C)sc1cnccc13.Cc1nc2cc3c(cc2o1)c1cc(SOOO)ccc1n3C.Cc1nc2cc3oc4c(SOOO)cc(SOOO)cc4c3cc2o1.Cc1nc2cc3oc4ccc(SOOO)cc4c3c(S(=O)(=O)O)c2o1.Cc1nc2cc3oc4ccc(SOOO)cc4c3cc2o1.Cc1nc2cc3sc4ccccc4c3cc2o1
InChIInChI=1S/C16H13N3S.C15H11N3S2.C15H12N2O4S.C14H11N3S.C14H15N3S.2C14H9NO8S2.C14H9NO5S.C14H9NOS/c1-2-20-16-18-14-8-11-7-10-5-3-4-6-12(10)17-13(11)9-15(14)19-16;1-2-19-15-18-13-7-11-12(8-14(13)20-15)17-10-6-4-3-5-9(10)16-11;1-8-16-12-7-14-11(6-15(12)19-8)10-5-9(22-21-20-18)3-4-13(10)17(14)2;1-8-16-11-5-10-9-3-4-15-7-14(9)18-13(10)6-12(11)17(8)2;1-3-17-13-8-10-6-5-7-15-11(10)9-12(13)16-14(17)18-4-2;1-6-15-10-5-11-8(4-12(10)18-6)9-2-7(24-22-20-16)3-13(14(9)19-11)25-23-21-17;1-6-15-9-5-11-12(14(13(9)20-6)25(17,18)19)8-4-7(24-23-22-16)2-3-10(8)21-11;1-7-15-11-6-13-10(5-14(11)17-7)9-4-8(21-20-19-16)2-3-12(9)18-13;1-8-15-11-7-14-10(6-12(11)16-8)9-4-2-3-5-13(9)17-14/h3-9,17H,2H2,1H3;3-8H,2H2,1H3;3-7,18H,1-2H3;3-7H,1-2H3;5-9H,3-4H2,1-2H3;2-5,16-17H,1H3;2-5,16H,1H3,(H,17,18,19);2-6,16H,1H3;2-7H,1H3
InChIKeyDFECBHXTFYGCQX-UHFFFAOYSA-N
MW2713.12 g/mol
LogP38.02
Rot. Bonds23

About 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid

12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid (PubChem CID 159001578) has the molecular formula C130H98N18O26S12 and a molecular weight of 2713.12 g/mol. Its IUPAC name is 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid.

Molecular Properties

Compound Name12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid
PubChem CID159001578
Molecular FormulaC130H98N18O26S12
Molecular Weight2713.12 g/mol
Exact Mass2710.35
IUPAC Name12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid
SMILESCCSc1nc2cc3cc4ccccc4[nH]c3cc2n1.CCSc1nc2cc3nc4ccccc4nc3cc2s1.CCSc1nc2cc3ncccc3cc2n1CC.Cc1nc2cc3c(cc2n1C)sc1cnccc13.Cc1nc2cc3c(cc2o1)c1cc(SOOO)ccc1n3C.Cc1nc2cc3oc4c(SOOO)cc(SOOO)cc4c3cc2o1.Cc1nc2cc3oc4ccc(SOOO)cc4c3c(S(=O)(=O)O)c2o1.Cc1nc2cc3oc4ccc(SOOO)cc4c3cc2o1.Cc1nc2cc3sc4ccccc4c3cc2o1
InChIInChI=1S/C16H13N3S.C15H11N3S2.C15H12N2O4S.C14H11N3S.C14H15N3S.2C14H9NO8S2.C14H9NO5S.C14H9NOS/c1-2-20-16-18-14-8-11-7-10-5-3-4-6-12(10)17-13(11)9-15(14)19-16;1-2-19-15-18-13-7-11-12(8-14(13)20-15)17-10-6-4-3-5-9(10)16-11;1-8-16-12-7-14-11(6-15(12)19-8)10-5-9(22-21-20-18)3-4-13(10)17(14)2;1-8-16-11-5-10-9-3-4-15-7-14(9)18-13(10)6-12(11)17(8)2;1-3-17-13-8-10-6-5-7-15-11(10)9-12(13)16-14(17)18-4-2;1-6-15-10-5-11-8(4-12(10)18-6)9-2-7(24-22-20-16)3-13(14(9)19-11)25-23-21-17;1-6-15-9-5-11-12(14(13(9)20-6)25(17,18)19)8-4-7(24-23-22-16)2-3-10(8)21-11;1-7-15-11-6-13-10(5-14(11)17-7)9-4-8(21-20-19-16)2-3-12(9)18-13;1-8-15-11-7-14-10(6-12(11)16-8)9-4-2-3-5-13(9)17-14/h3-9,17H,2H2,1H3;3-8H,2H2,1H3;3-7,18H,1-2H3;3-7H,1-2H3;5-9H,3-4H2,1-2H3;2-5,16-17H,1H3;2-5,16H,1H3,(H,17,18,19);2-6,16H,1H3;2-7H,1H3
InChIKeyDFECBHXTFYGCQX-UHFFFAOYSA-N
XLogP38.02
TPSA563.98 Ų
H-Bond Donors7
H-Bond Acceptors53
Rotatable Bonds23
Heavy Atoms186
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002713.12
LogP ≤ 538.02
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1053

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulfur_oxygen_single_bond', 'substructure': 'N/A'}

Analyze 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid?
The IUPAC name of 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid (CID 159001578) is 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid.
What is the SMILES notation for 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid?
The canonical SMILES for 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid is CCSc1nc2cc3cc4ccccc4[nH]c3cc2n1.CCSc1nc2cc3nc4ccccc4nc3cc2s1.CCSc1nc2cc3ncccc3cc2n1CC.Cc1nc2cc3c(cc2n1C)sc1cnccc13.Cc1nc2cc3c(cc2o1)c1cc(SOOO)ccc1n3C.Cc1nc2cc3oc4c(SOOO)cc(SOOO)cc4c3cc2o1.Cc1nc2cc3oc4ccc(SOOO)cc4c3c(S(=O)(=O)O)c2o1.Cc1nc2cc3oc4ccc(SOOO)cc4c3cc2o1.Cc1nc2cc3sc4ccccc4c3cc2o1.
What is the InChIKey of 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid?
The InChIKey is DFECBHXTFYGCQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3S.C15H11N3S2.C15H12N2O4S.C14H11N3S.C14H15N3S.2C14H9NO8S2.C14H9NO5S.C14H9NOS/c1-2-20-16-18-14-8-11-7-10-5-3-4-6-12(10)17-13(11)9-15(14)19-16;1-2-19-15-18-13-7-11-12(8-14(13)20-15)17-10-6-4-3-5-9(10)16-11;1-8-16-12-7-14-11(6-15(12)19-8)10-5-9(22-21-20-18)3-4-13(10)17(14)2;1-8-16-11-5-10-9-3-4-15-7-14(9)18-13(10)6-12(11)17(8)2;1-3-17-13-8-10-6-5-7-15-11(10)9-12(13)16-14(17)18-4-2;1-6-15-10-5-11-8(4-12(10)18-6)9-2-7(24-22-20-16)3-13(14(9)19-11)25-23-21-17;1-6-15-9-5-11-12(14(13(9)20-6)25(17,18)19)8-4-7(24-23-22-16)2-3-10(8)21-11;1-7-15-11-6-13-10(5-14(11)17-7)9-4-8(21-20-19-16)2-3-12(9)18-13;1-8-15-11-7-14-10(6-12(11)16-8)9-4-2-3-5-13(9)17-14/h3-9,17H,2H2,1H3;3-8H,2H2,1H3;3-7,18H,1-2H3;3-7H,1-2H3;5-9H,3-4H2,1-2H3;2-5,16-17H,1H3;2-5,16H,1H3,(H,17,18,19);2-6,16H,1H3;2-7H,1H3.
What are the key properties of 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid?
12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid has a molecular weight of 2713.12 g/mol, XLogP of 38.02, 23 rotatable bonds, 7 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 12,13-dimethyl-8-thia-5,12,14-triazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(16),2(7),3,5,9,11(15),13-heptaene;2,9-dimethyl-6-(trioxidanylsulfanyl)-[1,3]oxazolo[4,5-b]carbazole;1-ethyl-2-ethylsulfanylimidazo[4,5-g]quinoline;2-ethylsulfanyl-5H-imidazo[4,5-b]acridine;2-ethylsulfanyl-[1,3]thiazolo[5,4-b]phenazine;2-methyl-[1]benzothiolo[2,3-f][1,3]benzoxazole;2-methyl-6,8-bis(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole;2-methyl-6-(trioxidanylsulfanyl)-[1]benzofuro[2,3-f][1,3]benzoxazole-4-sulfonic acid is sourced from PubChem (CID 159001578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).