import {z} from 'zod' export type GetApiSynapseDrugCompoundPhysicochemicalPropsArgs = {inchi_key: string}; export type GetApiSynapseDrugCompoundPhysicochemicalPropsOptions = {baseUrl?: string | undefined, bearerAuth?: string | undefined, fetch?: typeof fetch | undefined}; export const b015DrugCompoundPhysicochemicalPropsChemicalToxnet = z.object({bp: z.array(z.unknown()).optional(), mp: z.array(z.unknown()).optional(), ctp: z.array(z.unknown()).optional(), den: z.array(z.unknown()).optional(), dsc: z.array(z.unknown()).optional(), htc: z.array(z.unknown()).optional(), htv: z.array(z.unknown()).optional(), sol: z.array(z.unknown()).optional(), vap: z.array(z.unknown()).optional(), cofo: z.array(z.unknown()).optional(), fpot: z.array(z.unknown()).optional(), name: z.string().optional(), ocpp: z.array(z.unknown()).optional(), owpc: z.array(z.unknown()).optional(), spec: z.array(z.unknown()).optional(), surf: z.array(z.unknown()).optional(), tast: z.array(z.unknown()).optional(), vapd: z.array(z.unknown()).optional(), visc: z.array(z.unknown()).optional()}); export const b015DrugCompoundPhysicochemicalPropsDrugChemStructPropsResponse = z.object({cbu: z.number().int().optional(), das: z.number().int().optional(), dbs: z.number().int().optional(), hba: z.number().int().optional(), hbd: z.number().int().optional(), psa: z.number().optional(), ro5: z.number().int().optional(), rtb: z.number().int().optional(), uas: z.number().int().optional(), ubs: z.number().int().optional(), charge: z.number().int().optional(), source: z.string().optional(), xlogp3: z.number().optional(), acd_logd: z.number().optional(), acd_logp: z.number().optional(), complexity: z.number().optional(), exact_mass: z.number().optional(), heavy_atom: z.number().int().optional(), mol_weight: z.number().optional(), source_url: z.string().optional(), mol_species: z.string().optional(), isotope_atom: z.number().int().optional(), chemical_toxnets: z.array(b015DrugCompoundPhysicochemicalPropsChemicalToxnet).optional(), monoisotopic_mass: z.number().optional()}); export const b015DrugCompoundPhysicochemicalPropsResponse = z.object({data: b015DrugCompoundPhysicochemicalPropsDrugChemStructPropsResponse.optional(), status: z.boolean(), error_msg: z.string().optional(), error_code: z.number().int()}); export const validateResponse = async ( schema: { readonly '~standard': { readonly validate: (value: unknown) => ({ readonly value: Output; readonly issues?: undefined } | { readonly issues: ReadonlyArray<{ readonly message: string; readonly path?: ReadonlyArray | undefined }> }) | Promise<{ readonly value: Output; readonly issues?: undefined } | { readonly issues: ReadonlyArray<{ readonly message: string; readonly path?: ReadonlyArray | undefined }> }> } }, value: unknown ): Promise => { const result = await schema['~standard'].validate(value) if (result.issues !== undefined) { const detail = result.issues .map(({ message, path }) => path?.length ? `${path.map((segment) => String(typeof segment === 'object' ? segment.key : segment)).join('.')}: ${message}` : message ) .join('; ') throw new Error(`Response does not match the schema: ${detail}`, { cause: { issues: result.issues } }) } return result.value }; /** * B015 Compound Physicochemical Properties * * GET /synapse/drug/compound-physicochemical-props */ export const getApiSynapseDrugCompoundPhysicochemicalProps = async (args: GetApiSynapseDrugCompoundPhysicochemicalPropsArgs, options?: GetApiSynapseDrugCompoundPhysicochemicalPropsOptions) => { const {baseUrl = "https://connect.patsnap.com", fetch: fetchFn = fetch, bearerAuth} = options ?? {} const query = new URLSearchParams() const headers = new Headers() headers.set('accept', "application/json") if (args.inchi_key != null) query.append("inchi_key", String(args.inchi_key)) if (bearerAuth !== undefined) headers.set('authorization', `Bearer ${bearerAuth}`) const url = `${baseUrl.replace(/\/+$/, '')}/synapse/drug/compound-physicochemical-props${query.size > 0 ? `?${query}` : ''}` const res = await fetchFn(url, {method: "GET", headers}) if (!res.ok) throw new Error(`Request failed with status ${res.status}`, {cause: {status: res.status, body: await res.text()}}) return validateResponse(b015DrugCompoundPhysicochemicalPropsResponse, await res.json()) };