Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Water | HCID 962 | — |
| Reactant | Tetrahydrofuran | HCID 8028 | — |
| Reactant | Phenyl vinyl sulfone | HCID 79664 | — |
| Reactant | 1-(3,4,5-trimethoxybenzoyl)-3-(2-(4-(1H-benzimidazol-2-yl)[1,4]diazepan-1-yl)ethyl)-3-phenylpyrrolidine | HCID 18464478 | — |
| Reactant | 2-(3-Phenylpyrrolidin-3-yl)ethanol | HCID 18464564 | — |
| Reactant | 3-Hydroxy-2-(4-methoxybenzoyl)-2-(4-methoxybenzoyl)oxybutanedioic acid | HCID 53442701 | — |
| Reactant | CID 53628100 | HCID 178418400 | — |
| Product | HCID 18464482 | HCID 18464482 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-54398a8c445b43009e7c43d0fd4f86b9 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
