(16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile

C126H123N38O17PS — CID 158474259

About (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile

(16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile (PubChem CID 158474259) has the molecular formula C126H123N38O17PS and a molecular weight of 2504.66 g/mol. Its IUPAC name is (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile.

Molecular Properties

• Compound Name: (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile
• PubChem CID: 158474259
• Molecular Formula: C126H123N38O17PS
• Molecular Weight: 2504.66 g/mol
• Exact Mass: 2502.94
• IUPAC Name: (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile
• SMILES: Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)C(=O)N(C)C2=O.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)C(=O)N(C)S2(=O)=O.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)N(C)/C(N(C)C)=N/2.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)NC(=O)N2.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)NC(=O)O2.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)OP(C)(=O)O2
• InChI: InChI=1S/C23H26N8O.C22H20N6O3.C21H20N6O4S.C20H19N7O2.C20H18N6O3.C20H20N5O4P/c1-13-7-8-17-16(9-13)14(2)32-19-10-15(12-26-21(19)25)20-18(11-24)31(6)28-22(20)30(5)23(27-17)29(3)4;1-11-5-6-14-15(7-11)12(2)31-17-8-13(10-25-20(17)24)18-16(9-23)28(4)26-19(18)22(30)27(3)21(14)29;1-11-5-6-17-14(7-11)12(2)31-16-8-13(10-24-20(16)23)18-15(9-22)26(3)25-19(18)21(28)27(4)32(17,29)30;1-10-4-5-14-13(6-10)11(2)29-16-7-12(9-23-18(16)22)17-15(8-21)27(3)26-19(17)25-20(28)24-14;1-10-4-5-15-13(6-10)11(2)28-16-7-12(9-23-18(16)22)17-14(8-21)26(3)25-19(17)24-20(27)29-15;1-11-5-6-16-14(7-11)12(2)27-17-8-13(10-23-19(17)22)18-15(9-21)25(3)24-20(18)29-30(4,26)28-16/h7-10,12,14H,1-6H3,(H2,25,26);5-8,10,12H,1-4H3,(H2,24,25);5-8,10,12H,1-4H3,(H2,23,24);4-7,9,11H,1-3H3,(H2,22,23)(H2,24,25,26,28);4-7,9,11H,1-3H3,(H2,22,23)(H,24,25,27);5-8,10,12H,1-4H3,(H2,22,23)/b27-23+;;;;;/t14-;2*12-;2*11-;12-,30?/m111111/s1
• InChIKey: HGSUWNMKXDABPR-JILBRDQUSA-N
• XLogP: 18.78
• TPSA: 764.16 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 50
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2504.66
LogP ≤ 5	18.78
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	50

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile?

The IUPAC name of (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile (CID 158474259) is (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile.

What is the SMILES notation for (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile?

The canonical SMILES for (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile is Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)C(=O)N(C)C2=O.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)C(=O)N(C)S2(=O)=O.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)N(C)/C(N(C)C)=N/2.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)NC(=O)N2.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)NC(=O)O2.Cc1ccc2c(c1)[C@@H](C)Oc1cc(cnc1N)-c1c(nn(C)c1C#N)OP(C)(=O)O2.

What is the InChIKey of (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile?

The InChIKey is HGSUWNMKXDABPR-JILBRDQUSA-N. The full InChI is InChI=1S/C23H26N8O.C22H20N6O3.C21H20N6O4S.C20H19N7O2.C20H18N6O3.C20H20N5O4P/c1-13-7-8-17-16(9-13)14(2)32-19-10-15(12-26-21(19)25)20-18(11-24)31(6)28-22(20)30(5)23(27-17)29(3)4;1-11-5-6-14-15(7-11)12(2)31-17-8-13(10-25-20(17)24)18-16(9-23)28(4)26-19(18)22(30)27(3)21(14)29;1-11-5-6-17-14(7-11)12(2)31-16-8-13(10-24-20(16)23)18-15(9-22)26(3)25-19(18)21(28)27(4)32(17,29)30;1-10-4-5-14-13(6-10)11(2)29-16-7-12(9-23-18(16)22)17-15(8-21)27(3)26-19(17)25-20(28)24-14;1-10-4-5-15-13(6-10)11(2)28-16-7-12(9-23-18(16)22)17-14(8-21)26(3)25-19(17)24-20(27)29-15;1-11-5-6-16-14(7-11)12(2)27-17-8-13(10-23-19(17)22)18-15(9-21)25(3)24-20(18)29-30(4,26)28-16/h7-10,12,14H,1-6H3,(H2,25,26);5-8,10,12H,1-4H3,(H2,24,25);5-8,10,12H,1-4H3,(H2,23,24);4-7,9,11H,1-3H3,(H2,22,23)(H2,24,25,26,28);4-7,9,11H,1-3H3,(H2,22,23)(H,24,25,27);5-8,10,12H,1-4H3,(H2,22,23)/b27-23+;;;;;/t14-;2*12-;2*11-;12-,30?/m111111/s1.

What are the key properties of (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile?

(16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile has a molecular weight of 2504.66 g/mol, XLogP of 18.78, 0 rotatable bonds, 9 hydrogen bond donors, and 50 hydrogen bond acceptors.

Where does this data come from?

All data for (16R)-19-amino-8-(dimethylamino)-4,7,13,16-tetramethyl-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,8,10(15),11,13,18,20-nonaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9-dioxo-17-oxa-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-8-oxo-7,9,17-trioxa-4,5,20-triaza-8λ5-phosphatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,8,13,16-tetramethyl-7,9,9-trioxo-17-oxa-9λ6-thia-4,5,8,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-9,17-dioxa-4,5,7,20-tetrazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile;(16R)-19-amino-4,13,16-trimethyl-8-oxo-17-oxa-4,5,7,9,20-pentazatetracyclo[16.3.1.02,6.010,15]docosa-1(22),2,5,10(15),11,13,18,20-octaene-3-carbonitrile is sourced from PubChem (CID 158474259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).