(4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate

C147H178N16O38 — CID 157113660

About (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate

(4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate (PubChem CID 157113660) has the molecular formula C147H178N16O38 and a molecular weight of 2777.11 g/mol. Its IUPAC name is (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate.

Molecular Properties

• Compound Name: (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate
• PubChem CID: 157113660
• Molecular Formula: C147H178N16O38
• Molecular Weight: 2777.11 g/mol
• Exact Mass: 2775.25
• IUPAC Name: (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate
• SMILES: CC(C)NCc1ccc(-c2ccc(O)c3c2CC2CC4CC(=O)C(C(N)=O)=C(O)C4C(=O)C2=C3O)o1.CN(C)C1C(=O)C(C(N)=O)=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)c(CN)cc(-c5ccc(C(C)(C)C)cc5)c4C[C@H]3C[C@@H]12.CN(C)Cc1ccc(-c2ccc(O)c3c2C[C@H]2C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C2=C3O)o1.CN(C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)ccc(C(=O)Cc5ccccn5)c4C[C@H]3C[C@@H]12.CN(C)c1ccc(-c2cc(CN)c(O)c3c2CC2CC4CC(=O)C(C(N)=O)=C(O)C4C(=O)C2=C3O)cc1.CNC.CNC.O.O.[H][H].[H][H].[H][H].[H][H]
• InChI: InChI=1S/C32H37N3O7.C28H31N3O8.C28H27N3O8.C28H29N3O6.C27H28N2O7.2C2H7N.2H2O.4H2/c1-31(2,3)17-8-6-14(7-9-17)18-11-16(13-33)25(36)22-19(18)10-15-12-20-24(35(4)5)27(38)23(30(34)41)29(40)32(20,42)28(39)21(15)26(22)37;1-30(2)11-13-5-8-18(39-13)14-6-7-17(32)20-15(14)9-12-10-16-22(31(3)4)24(34)21(27(29)37)26(36)28(16,38)25(35)19(12)23(20)33;1-31(2)22-16-10-12-9-15-14(18(33)11-13-5-3-4-8-30-13)6-7-17(32)20(15)23(34)19(12)25(36)28(16,39)26(37)21(24(22)35)27(29)38;1-31(2)16-5-3-12(4-6-16)17-9-15(11-29)24(33)22-18(17)8-13-7-14-10-19(32)23(28(30)37)27(36)21(14)25(34)20(13)26(22)35;1-11(2)29-10-14-3-6-19(36-14)15-4-5-17(30)22-16(15)8-12-7-13-9-18(31)23(27(28)35)26(34)21(13)24(32)20(12)25(22)33;2*1-3-2;;;;;;/h6-9,11,15,20,24,36-37,40,42H,10,12-13,33H2,1-5H3,(H2,34,41);5-8,12,16,22,32-33,36,38H,9-11H2,1-4H3,(H2,29,37);3-8,12,16,22,32,34,37,39H,9-11H2,1-2H3,(H2,29,38);3-6,9,13-14,21,33,35-36H,7-8,10-11,29H2,1-2H3,(H2,30,37);3-6,11-13,21,29-30,33-34H,7-10H2,1-2H3,(H2,28,35);2*3H,1-2H3;2*1H2;4*1H/t15-,20-,24?,32-;2*12-,16-,22-,28-;;;;;;;;;;/m000........../s1
• InChIKey: FKULZCOMZDNCOP-JAIHPARISA-N
• XLogP: 9.03
• TPSA: 973.86 Ų
• H-Bond Donors: 28
• H-Bond Acceptors: 47
• Rotatable Bonds: 23
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2777.11
LogP ≤ 5	9.03
H-Bond Donors ≤ 5	28
H-Bond Acceptors ≤ 10	47

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_4', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate?

The IUPAC name of (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate (CID 157113660) is (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate.

What is the SMILES notation for (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate?

The canonical SMILES for (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate is CC(C)NCc1ccc(-c2ccc(O)c3c2CC2CC4CC(=O)C(C(N)=O)=C(O)C4C(=O)C2=C3O)o1.CN(C)C1C(=O)C(C(N)=O)=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)c(CN)cc(-c5ccc(C(C)(C)C)cc5)c4C[C@H]3C[C@@H]12.CN(C)Cc1ccc(-c2ccc(O)c3c2C[C@H]2C[C@H]4[C@H](N(C)C)C(=O)C(C(N)=O)=C(O)[C@@]4(O)C(=O)C2=C3O)o1.CN(C)[C@@H]1C(=O)C(C(N)=O)=C(O)[C@@]2(O)C(=O)C3=C(O)c4c(O)ccc(C(=O)Cc5ccccn5)c4C[C@H]3C[C@@H]12.CN(C)c1ccc(-c2cc(CN)c(O)c3c2CC2CC4CC(=O)C(C(N)=O)=C(O)C4C(=O)C2=C3O)cc1.CNC.CNC.O.O.[H][H].[H][H].[H][H].[H][H].

What is the InChIKey of (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate?

The InChIKey is FKULZCOMZDNCOP-JAIHPARISA-N. The full InChI is InChI=1S/C32H37N3O7.C28H31N3O8.C28H27N3O8.C28H29N3O6.C27H28N2O7.2C2H7N.2H2O.4H2/c1-31(2,3)17-8-6-14(7-9-17)18-11-16(13-33)25(36)22-19(18)10-15-12-20-24(35(4)5)27(38)23(30(34)41)29(40)32(20,42)28(39)21(15)26(22)37;1-30(2)11-13-5-8-18(39-13)14-6-7-17(32)20-15(14)9-12-10-16-22(31(3)4)24(34)21(27(29)37)26(36)28(16,38)25(35)19(12)23(20)33;1-31(2)22-16-10-12-9-15-14(18(33)11-13-5-3-4-8-30-13)6-7-17(32)20(15)23(34)19(12)25(36)28(16,39)26(37)21(24(22)35)27(29)38;1-31(2)16-5-3-12(4-6-16)17-9-15(11-29)24(33)22-18(17)8-13-7-14-10-19(32)23(28(30)37)27(36)21(14)25(34)20(13)26(22)35;1-11(2)29-10-14-3-6-19(36-14)15-4-5-17(30)22-16(15)8-12-7-13-9-18(31)23(27(28)35)26(34)21(13)24(32)20(12)25(22)33;2*1-3-2;;;;;;/h6-9,11,15,20,24,36-37,40,42H,10,12-13,33H2,1-5H3,(H2,34,41);5-8,12,16,22,32-33,36,38H,9-11H2,1-4H3,(H2,29,37);3-8,12,16,22,32,34,37,39H,9-11H2,1-2H3,(H2,29,38);3-6,9,13-14,21,33,35-36H,7-8,10-11,29H2,1-2H3,(H2,30,37);3-6,11-13,21,29-30,33-34H,7-10H2,1-2H3,(H2,28,35);2*3H,1-2H3;2*1H2;4*1H/t15-,20-,24?,32-;2*12-,16-,22-,28-;;;;;;;;;;/m000........../s1.

What are the key properties of (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate?

(4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate has a molecular weight of 2777.11 g/mol, XLogP of 9.03, 23 rotatable bonds, 28 hydrogen bond donors, and 47 hydrogen bond acceptors.

Where does this data come from?

All data for (4aS,5aR,12aR)-9-(aminomethyl)-7-(4-tert-butylphenyl)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-7-(2-pyridin-2-ylacetyl)-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;(4S,4aS,5aR,12aR)-4-(dimethylamino)-7-[5-[(dimethylamino)methyl]furan-2-yl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;9-(aminomethyl)-7-[4-(dimethylamino)phenyl]-1,10,11-trihydroxy-3,12-dioxo-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;bis(N-methylmethanamine);molecular hydrogen;1,10,11-trihydroxy-3,12-dioxo-7-[5-[(propan-2-ylamino)methyl]furan-2-yl]-4,4a,5,5a,6,12a-hexahydrotetracene-2-carboxamide;dihydrate is sourced from PubChem (CID 157113660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).