[[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

C60H89F14N13O76P18S7 — CID 158593692

About [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate

[[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate (PubChem CID 158593692) has the molecular formula C60H89F14N13O76P18S7 and a molecular weight of 3256.36 g/mol. Its IUPAC name is [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.

Molecular Properties

• Compound Name: [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
• PubChem CID: 158593692
• Molecular Formula: C60H89F14N13O76P18S7
• Molecular Weight: 3256.36 g/mol
• Exact Mass: 3254.66
• IUPAC Name: [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
• SMILES: Nc1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C2(O)CF)c(=S)n1.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=S)[nH]c2=S)C(O)(CF)[C@H]1F.O=c1[nH]c(=S)c(F)cn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C1(O)CF.O=c1[nH]c(=S)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C1(O)CF.O=c1[nH]c(=S)n([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C2(O)CF)cc1F.O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C2(O)CF)c(=S)[nH]1
• InChI: InChI=1S/2C10H14F3N2O13P3S.C10H16F2N3O12P3S.2C10H15F2N2O13P3S.C10H15F2N2O12P3S2/c11-3-10(17)6(13)5(26-8(10)15-1-4(12)7(32)14-9(15)16)2-25-30(21,22)28-31(23,24)27-29(18,19)20;11-3-10(17)6(13)5(26-8(10)15-1-4(12)7(16)14-9(15)32)2-25-30(21,22)28-31(23,24)27-29(18,19)20;11-4-10(16)7(12)5(25-8(10)15-2-1-6(13)14-9(15)31)3-24-29(20,21)27-30(22,23)26-28(17,18)19;11-4-10(16)7(12)5(25-8(10)14-2-1-6(31)13-9(14)15)3-24-29(20,21)27-30(22,23)26-28(17,18)19;11-4-10(16)7(12)5(25-8(10)14-2-1-6(15)13-9(14)31)3-24-29(20,21)27-30(22,23)26-28(17,18)19;11-4-10(15)7(12)5(24-8(10)14-2-1-6(30)13-9(14)31)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h2*1,5-6,8,17H,2-3H2,(H,21,22)(H,23,24)(H,14,16,32)(H2,18,19,20);1-2,5,7-8,16H,3-4H2,(H,20,21)(H,22,23)(H2,13,14,31)(H2,17,18,19);2*1-2,5,7-8,16H,3-4H2,(H,20,21)(H,22,23)(H,13,15,31)(H2,17,18,19);1-2,5,7-8,15H,3-4H2,(H,19,20)(H,21,22)(H,13,30,31)(H2,16,17,18)/t2*5-,6+,8-,10?;4*5-,7+,8-,10?/m111111/s1
• InChIKey: HUTHDRKJQFPUCQ-KSRTYBNOSA-N
• XLogP: 3.05
• TPSA: 1351.40 Ų
• H-Bond Donors: 36
• H-Bond Acceptors: 67
• Rotatable Bonds: 54
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3256.36
LogP ≤ 5	3.05
H-Bond Donors ≤ 5	36
H-Bond Acceptors ≤ 10	67

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate?

The IUPAC name of [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate (CID 158593692) is [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.

What is the SMILES notation for [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate?

The canonical SMILES for [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate is Nc1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C2(O)CF)c(=S)n1.O=P(O)(O)OP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2ccc(=S)[nH]c2=S)C(O)(CF)[C@H]1F.O=c1[nH]c(=S)c(F)cn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C1(O)CF.O=c1[nH]c(=S)ccn1[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C1(O)CF.O=c1[nH]c(=S)n([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C2(O)CF)cc1F.O=c1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H](F)C2(O)CF)c(=S)[nH]1.

What is the InChIKey of [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate?

The InChIKey is HUTHDRKJQFPUCQ-KSRTYBNOSA-N. The full InChI is InChI=1S/2C10H14F3N2O13P3S.C10H16F2N3O12P3S.2C10H15F2N2O13P3S.C10H15F2N2O12P3S2/c11-3-10(17)6(13)5(26-8(10)15-1-4(12)7(32)14-9(15)16)2-25-30(21,22)28-31(23,24)27-29(18,19)20;11-3-10(17)6(13)5(26-8(10)15-1-4(12)7(16)14-9(15)32)2-25-30(21,22)28-31(23,24)27-29(18,19)20;11-4-10(16)7(12)5(25-8(10)15-2-1-6(13)14-9(15)31)3-24-29(20,21)27-30(22,23)26-28(17,18)19;11-4-10(16)7(12)5(25-8(10)14-2-1-6(31)13-9(14)15)3-24-29(20,21)27-30(22,23)26-28(17,18)19;11-4-10(16)7(12)5(25-8(10)14-2-1-6(15)13-9(14)31)3-24-29(20,21)27-30(22,23)26-28(17,18)19;11-4-10(15)7(12)5(24-8(10)14-2-1-6(30)13-9(14)31)3-23-28(19,20)26-29(21,22)25-27(16,17)18/h2*1,5-6,8,17H,2-3H2,(H,21,22)(H,23,24)(H,14,16,32)(H2,18,19,20);1-2,5,7-8,16H,3-4H2,(H,20,21)(H,22,23)(H2,13,14,31)(H2,17,18,19);2*1-2,5,7-8,16H,3-4H2,(H,20,21)(H,22,23)(H,13,15,31)(H2,17,18,19);1-2,5,7-8,15H,3-4H2,(H,19,20)(H,21,22)(H,13,30,31)(H2,16,17,18)/t2*5-,6+,8-,10?;4*5-,7+,8-,10?/m111111/s1.

What are the key properties of [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate?

[[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate has a molecular weight of 3256.36 g/mol, XLogP of 3.05, 54 rotatable bonds, 36 hydrogen bond donors, and 67 hydrogen bond acceptors.

Where does this data come from?

All data for [[(2R,3S,5R)-5-(4-amino-2-sulfanylidenepyrimidin-1-yl)-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-5-[2,4-bis(sulfanylidene)pyrimidin-1-yl]-3-fluoro-4-(fluoromethyl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-2-oxo-4-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-5-(5-fluoro-4-oxo-2-sulfanylidenepyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(2-oxo-4-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;[[(2R,3S,5R)-3-fluoro-4-(fluoromethyl)-4-hydroxy-5-(4-oxo-2-sulfanylidenepyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate is sourced from PubChem (CID 158593692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).